recent developments and applications in enantioselective desymmetrisation

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Recent Developments and Applications in Enantioselective Desymmetrisation Xin Linghu Department of Chemistry University of North Carolina, Chapel Hill

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Recent Developments and Applications in Enantioselective Desymmetrisation. Xin Linghu Department of Chemistry University of North Carolina, Chapel Hill. Outline. Introduction Enantioselective Desymmetrisation of Different Functional Groups Cyclic anhydrides Epoxides - PowerPoint PPT Presentation

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Page 1: Recent Developments and Applications in Enantioselective Desymmetrisation

Recent Developments and Applications in Enantioselective Desymmetrisation

Xin Linghu

Department of ChemistryUniversity of North Carolina, Chapel Hill

Page 2: Recent Developments and Applications in Enantioselective Desymmetrisation

Outline

Introduction

Enantioselective Desymmetrisation of Different Functional Groups

Cyclic anhydrides Epoxides Aldehydes and Ketones Alkenes Diols

Summary

Acknowledgement

Page 3: Recent Developments and Applications in Enantioselective Desymmetrisation

Introduction to Enantioselective Desymmetrisation

achiral molecule (meso)

mirror plane

inversion center

chiral reagent or catalyst

chiral molecule

Page 4: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Desymmetrisation in Total Synthesis

1987, Schreiber:

1992, Harada:

Me Me Me MeMe Me

OTBS OBnOH OHOH OH

d-menthone enol TMS etherTfOH, THF, -40 ¡ãC, 2 h

61%

O O O O O OOH OH

Me Me Me Me t-BuOOHTi(OiPr)4

L-(+)-DIPT

81%

O O O OOH OH

Me Me Me Me

O

Me Me Me Me

OBnOH OOH O

Me Me Me Me

OBnO OHO OH+

4.5:1

Page 5: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Desymmetrisation of Cyclic Anhydride: Previous Work

OO O

10 mol% cinchonine4 equiv MeOH

toluene, RT, 4 d>95%, 70% ee

MeO2C CO2H

O

O

O

110 mol% quinidine3 equiv MeOH

toluene/CCl4, -55 ¡ãC, 60 h98%, 99% ee CO2H

CO2Me

O

O

O

120 mol%TADDOL A:Ti(OiPr)4 (1:1)

THF, -30 ¡ãC, 5 d91%, 98% ee CO2iPr

CO2H

O

O

O

120 mol%TADDOL B:Ti(OiPr)4 (1:1)

THF, -34 ¡ãC, 24 d74%, 96% ee CO2iPr

CO2H

1985, Oda:

1999, Bolm:

1995, Seebach:

N

H

OH

N

R

98

  

R C-8 C-9

H R S cinchonine

H S R cinchonidine

OMe S R quinine

OMe R S quinidine

configuration

O

O OH

OH

Ar Ar

Ar Ar

TADDOL A: Ar=PhTADDOL B: Ar=2-Nap

Page 6: Recent Developments and Applications in Enantioselective Desymmetrisation

Formation of C-X Bond via Anhydrides

O

O

O

+ MeOH

catalyst (5-30 mol%)toluene, -20 or -40 ¡ãC CO2H

CO2Me

H

H

H

H

R

R

R

RN

H

O

N

OMe

DHQD (dihydroquinidyl)

O

O

O

O

N

OMe

N

OMe

N

N

H

H

(DHQD)2AQN

CO2H

CO2Me

CO2H

CO2Me

H

H

H

H

CO2H

CO2Me

H

H

CO2H

CO2Me

CO2H

CO2Me

CO2H

CO2Me

OCO2H

CO2Me

CO2HCO2Me

CO2H

CO2Me

99% 95% ee 95% 98% ee 97% 97% ee

93% 98% ee 70% 91% ee 72% 92% ee

88% 96% ee 74% 92% ee 82% 95% ee

Chen, Y.; Tian, S.-K.; Deng, L. J. Am. Chem. Soc. 2000, 122, 9542-9543.

Page 7: Recent Developments and Applications in Enantioselective Desymmetrisation

Formation of C-C Bond via Anhydrides

O

O

O

H

H

+ Et2Zn

20 mol% Ni(COD)2,22 mol% ligand CO2H

H

HA (0.4 equiv)

THF, 12 h, 0 to 25 ¡ãC

Et

O

N PPh2

F3C

pyphos

A

ligand yields (%)

pyphos 80bipy 92PPh3 (2 equiv) <5dppe 20dppb 78

R

R

O

O

O

H

H

+ Et2Zn

10 mol% Ni(COD)2,12 mol% bipy or pyphos

R

R CO2HH

H

61-96% yields Et

O

chiral ligand

BINAP, DIOP, DuPHOS

PPh2 N

O

i-Pr

no reactionor low yields

85% yield79% ee

O

O

O

H

H

+ Et2Zn

10 mol% Ni(COD)2,12 mol% chiral ligand CO2H

H

H

A (0.2 equiv)THF, 3 h, 0 ¡ãC

Et

O

Bercot, E. A.; Rovis, T. J. Am. Chem. Soc. 2002, 124, 174-175.

Page 8: Recent Developments and Applications in Enantioselective Desymmetrisation

Formation of C-C Bond via Anhydrides

OO O

Ph

+ PhMgCl1.0 equiv of ligand

toluene, -78 ¡ãC, 9 h Ph

O Ph

OH

O

*1.0 equiv

Me Ph

Me2N OH

MeO

Ph

OMe

Ph

N

NH

H

HH

N

O

N

O

Me Me

Ph Ph

N

H

OH

N

OMe

(+)-1(+)-2

(+)-3

(-)-4 (-)-5

entry ligand % ee yield (%)

1 (+)-1 1 76

2 (+)-2 12 76

3 (+)-3 32 66

4 (-)-4 39 77

5 (-)-5 88 63

Shintani, R.; Fu, G. C. Angew. Chem. Int. Ed. 2002, 41, 1057-1059.

Page 9: Recent Developments and Applications in Enantioselective Desymmetrisation

Formation of C-C Bond via Anhydrides

Shintani, R.; Fu, G. C. Angew. Chem. Int. Ed. 2002, 41, 1057-1059.

OO O

Ph

+ ArMgX

1.3 equiv of (-)-sparteine

toluene, -78 ¡ãC, 24 h Ar

O Ph

OH

O

1.3 equiv

OO O

R

+ PhMgCl

1.3 equiv of (-)-sparteine

toluene, -78¡ãC, 24h Ph

O R

OH

O

1.3 equiv

entry ArMgX % ee yield (%)

1 PhMgCl 92 91

2 p-MeOC6H4MgBr 89 88

3 p-FC6H4MgBr 78 82

4 o-TolMgCl 37 66

Ph

OH

O

PhO

Bn

OH

O

PhO

OH

O

PhO

OH

O

PhO

S

OH

O

PhO

Me

OH

O

PhO

Me

Me

OH

O

PhO

Me

Me

Me

OH

O

PhO

Me MeTBSO

OH

O

PhO

91% 92% ee 87% 92% ee 87% 88% ee

74% 91% ee 74% 90% ee 76% 91% ee

92% 70% ee 84% 91% ee 51% 87% ee

Page 10: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Desymmetrisation of Epoxides: Previous Work

O

R

R

iPrMe2SiN3, TMS-TFA

CH2Cl2, r.t. OHR

R N3

83-93% ee N

Me

Me

Me OH

HO OH

L*H3

1992, Nugent:

1998, Nugent: O

R

R

TMS-N3 (1.25 equiv)

(~20 equiv) OTMSR

R Br

84-95% ee

Br

PhCl, r.t., 48 h

L*Zr ZrL*(OtBu)2

L*Zr ZrL*(OtBu)2

O

R

R

TMS-N3, A (2 mol%)

OHR

R N3

82-98% ee

N N

O OCr

Cl

H H

t-Bu

t-Bu

t-Bu

t-Bu

N N

O OCo

H H

t-Bu

t-Bu

t-Bu

t-Bu

O

R

R

B (2.5-5.0 mol%),

OHR

R OCOPh

55-93% ee

1995, Jacobsen:

1997, Jacobsen:

A

B

PhCO2H, iPr2NEt

Page 11: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Desymmetrisation of Epoxides: Previous Work

O

O

O

OGa

Li

O

R

ROHR

R S-tBu

82-98% ee

1997, Shibasaki:toluene, r.t.

+ tBuSHCat. (10 mol), 4A MS

O

R

R

Cat. (10 mol%), SiCl4

OHR

R Cl

52-87% ee

1998, Denmark:CH2Cl2, -78 ¡ãC

N

N

PO

N

Me

Me

O + PhLiCat., BF3¡¤OBu2

Et2O, -78 ¡ãC

OH

Ph 99%, 47% ee

1996, Tomioka:MeO

Ph Ph

O

Ph

OMe

OCat. (20 mol%),

4 ¡ãC, toluene

TMSCN, Ti(OiPr)4CN

OTMS 80% conv, 86% ee

1996, Hoveyda and Snapper:

MeO

HN

N

O

OOMe

H

MeMeMe

Me MeMe

H

HO

F

Page 12: Recent Developments and Applications in Enantioselective Desymmetrisation

Fe

N

R R

RR

R

O

O

Ph Ph

+ SiCl4(-)-catalyst (10 mol%)

(i-Pr)2NEt, CH2Cl2 PhPh

OSiCl3

Cl

A: R = MeB: R = PhC: R = 3,5-Me2C6H3

Enantioselective Ring Opening Catalyzed by

Planar-Chiral Pyridine N-Oxides

Tao, B.; Lo, M. M. C.; Fu, G. C. J. Am. Chem. Soc. 2001, 123, 353-354.

catalyst temp % ee

A rt 11

B rt 25

B -78°C 60

C rt 68

C -78°C 92

O

R R

+ SiCl4(+)-C (5 mol%)

(i-Pr)2NEt, CH2Cl2, -85 ¡ãC

RR

OSiCl3

Cl

entry R yield (%) % ee

1 Ph 88 94

2 4-FC6H4 97 91

3 4-CH3C6H4 94 93

4 4-CF3C6H4 93 98

5 2-naphthyl 84 94

6 CH2OBn 91 50

Page 13: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Ring Opening Catalyzed by

Chiral Bipyridine N,N’-Dioxide Derivatives

O

R R

+ SiCl4cat. (10 mol%)

(i-Pr)2NEt (1.5 equiv), CH2Cl2, -78 ¡ãC, 6 h

RR

OSiCl3

Cl(2.0 equiv)

entry R yield (%) % ee (confgn)

1 Ph 95 90

2 CH2OCH2Ph 98 74

3 CH2O(CH2)3Ph 95 70

4 -(CH2)4- 83 0

N

N

O

O

Nakajima, M.; Saito, M.; Uemura, M.; Hashimoto, S. Tetrahedron Lett. 2002, 43, 8827-8829.

Page 14: Recent Developments and Applications in Enantioselective Desymmetrisation

Asymmetric Ring Opening with TMSCN Catalyzed by (pybox)Yb Complexes

O

R R

YbCl3 (5 mol%)ligand a or b (6 mol%)

TMSCN, CHCl3 RR

TMSO

CN

NO

N N

O

R Ra: R = t-Bub: R = Ph

entry substrate ligand temp (°C) time (d) yield (%)% ee

(confgn)

1 (S,S)-b -45 4 9091

(1S, 2R)

2 (S,S)-a -10 7 8392

(1R, 2S)

3 (S,S)-b -40 7 8090

(2S, 3R)

4 (S,S)-a 0 7 8683

(1R, 3S, 4R)

5 (S,S)-a -10 7 7287

(3R, 4R)

O

O

O

Me Me

O

CO2Et

N

O

COCF3

Schaus, S. E.; Jacobsen, E. N. Org. Lett. 2000, 2, 1001-1004.

Page 15: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Alkylation of Vinyloxiranes

O

ZnEt2/toluene1.5 mol% Cu(OTf)2

3 mol% 1 or 2

-70 ¡ãC to 0 ¡ãC, 3 h

Et

OH*

O

OP N

Me

Me

(S,S,S)-1

O

OP N

Me

Me

(S,R,R)-2

Et

OH

H

H

Et

OH

Et

OH

Et

OH

1 2 1 2 1 1

yield (%) 92 86 80 68 78 90

% ee 66 37 85 76 71 97

SN2’/SN2 >99/1 98/2 87/13 75/25 93/7 98/2

Bertozzi, F.; Crotti, P.; Macchia, F.; Pineschi, M.; Arnold, A.; Feringa, B. L. Org. Lett. 2000, 2, 933-936.

Page 16: Recent Developments and Applications in Enantioselective Desymmetrisation

Desymmetrisation by Enantioselective Deprotonation

( )n

O-deprotonation

( )n

O

Li

proton transferand ring opening

( )n

OLi

( )n

OH

O-deprotonation

OH

LiN

RR

OLi

H

H

H

Hodgson, D. M.; Gibbs, A. R.; Lee, G. P. Tetrahedron 1996, 52, 14361-14384.

Page 17: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective -Deprotonation of Epoxides: Previous Work

1996, Hodgson:

O

O

O

Et2O, -98 ¡ãC

H H

H H

H H

OH

OH

OH

PriLi andN

NH

H

HH

(-)-sparteine

86%, 84% ee

77%, 83% ee

97%, 77% ee

1996, Hodgson:

Li

O O

Et2O, 0 ¡ãC to rt Ph NLi

Ph

BusLi andpentane, -78 ¡ãC to rt

OH

OH

73%, 49% ee

73%, 52% eeN

NH

H

HH

(-)-sparteine

Page 18: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective -Deprotonation of Epoxides: Previous Work

O Ph NLi

Ph

THF, reflux OH65%, 36% op

BnO O

C6H6/THF,-78 ¡ãC to rt BnO

OH

98%, 80% eeLiHN OLi

Me Ph

O

THF/DBU (10 mol%)0 ¡ãC, 24 h OH

91%, 96% eeNLi

N

1980, Whitesell and

Felman:

1993, Milne and

Murphy:

1998, Andersson:

Page 19: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Alkylative Double Ring Opening of Epoxides

O

N N

O

N

NH

H1 2

OO

n( )

iPrLi or nBuLi/1 or 2

Et2O or cumene-78 ¡ãC (5h) to rt (16h)

n( )

HOOH

Bu/iPr

HO

Bu

OH

Bu

OH

Bu

OH

iPr

OH

OH OH OH

MeO

MeO

O

O

iPr

OHOH

iPr

OH

OH

iPr

OH

OH

iPr

OH

OH

TBSO TBSO

46%, 34% ee 57%, 27% ee 50%, 51% ee 44%, 74% ee

42%, 56% ee 44%, 85% ee 46%, 69% ee 54%, 84% ee

Hodgson, D. M.; Maxwell, C. R.; Miles, T. J.; Paruch, E.; Stent, M. A. H.; Matthews, I. R.;

Wilson, F. X.; Witherington, J. Angew. Chem. Int. Ed. 2002, 41, 4313-4316.

X ORLi

X O XRLi

R

Li

OLiHX

R

OHLi

Page 20: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Alkylative Double Ring Opening of Epoxides

Hodgson, D. M.; Maxwell, C. R.; Miles, T. J.; Paruch, E.; Stent, M. A. H.; Matthews, I. R.;

Wilson, F. X.; Witherington, J. Angew. Chem. Int. Ed. 2002, 41, 4313-4316.

XN

On( )

iPrLi or nBuLi/1 or 2

Et2O-78 ¡ãC (5h) to rt (16h)

n( )

XHNOH

Bu/iPr

BusHN

Bu

OH

iPr

OH

iPr

OH

NHBus

NHBoc

CH2TMS

OH

NHBoc

iPr

OH

NHBoc

Bu

OH

NHBoc

TBSO

TBSO

79%, 45% ee 25%, 45% ee 42%, 64% ee

78%, 87% ee 44%, 71% ee

61%, 57% ee

59%, 65% ee

68%, 79% ee

BocHN

Bu

OH

iPr

OH

NHBoc

iPr

OH

NHBoc

85%, 71% ee

MeOTBSO

Page 21: Recent Developments and Applications in Enantioselective Desymmetrisation

-Deprotonated Epoxides as Nucleophiles

entry E yield (%) % ee

1 TMS 72 74

2 SnBu3 60 79

3 PhCH(OH) 80 76

4 PhCO 68 77

5 Et2C(OH) 75 77

6 EtCH(OH) 74 76

7 EtCO 67 78

8 EtOCO 58 81

Hodgson, D. M.; Gras, E. Angew. Chem. Int. Ed. 2002, 41, 2376-2378.

OsBuLi/chiral amine

Et2O -78 ¡ãCO

LiE

O

E

N

NH

H

OHH

H

Page 22: Recent Developments and Applications in Enantioselective Desymmetrisation

First Desymmetrisation of Centrosymmetric Diepoxide in Natural Product Synthesis

O

O OH H Me

H OH

HHH

CHOHO Me

AB C

D

Hemibrevetoxin B

O

O

O Me

MeH

H

OO

A B

O

O

O

O

Me

MeH

H

O

O

MeO

OMe

Me

MeH

H

85% yield

O O

H H

MeO OMe

O O

O

O

O

O

5 mol% [(Cy3P)2RuCHPh]

CH2Cl2, 92%

m-CPBA,

98%

PPTS,

MeOH,

E:Z 2:1

Holland, J. M.; Lewis, M.; Nelson, A. Angew. Chem. Int. Ed. 2001, 40, 4082-4084.

Page 23: Recent Developments and Applications in Enantioselective Desymmetrisation

N N

O OCo

H H

t-Bu

t-Bu

t-Bu

t-Bu

OAc

Holland, J. M.; Lewis, M.; Nelson, A. Angew. Chem. Int. Ed. 2001, 40, 4082-4084.

First Desymmetrisation of Centrosymmetric Diepoxide in Natural Product Synthesis

O

O

Me

MeH

H

¡¤¡¤

O

O

OHC

CHO

Me

MeH

HTMS

Me3SiOTf, 92%

O

O

MeO

OMe

Me

MeH

HO3, then

Me2S

98%

d.r. >99:1

O

O

O

O

Me

MeH

HO

O

O Me

MeH

H

OHOH

20 mol% cat.,1.1 equiv H2O

MeCN/CH2Cl2>98% yield, >95% ee

(MeO)2CMe2,PPTS/CH2Cl2,

98%

Me3S(O)I,NaH, DMSO,75%

d.r. >20:1

O

O

O Me

MeH

H

OO

Page 24: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Desymmetrisation of Ketones and Aldehydes: Previous Work

NP

NMe

Me

O

Ph+

1. BuLi, -78 ¡ãC2. AcOH

PhO

tBu tBu

91%, >99:1 er

O

tBu

(EtO)2POEt

O O+

1. cat. (20 mol%), PhH, RbOH, rt, 191h

2. HCl/EtOH

O

OEt

tBu

69%, 57% ee

N

H

OH

N

OMe

Br

OHC CHO

Fe(CO)3

OHC

Fe(CO)3toluene:hexane4:1

R2Zn

N

Me OH

PhPh

R

OHH

R = Et, >98% eeR = Me, 86% ee

OHC CHO

Fe(CO)3

OHC

Fe(CO)3-78 ¡ãC, toluene

OHH

O

B O

CO2iPr

CO2iPr

>98% ee

1990, Roush:

1998, Takemoto:

1998, Arai and

Shioiri:

1984, Hanessian:

Page 25: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Desymmetrisation of Ketones and Aldehydes: Previous Work

O

Me

Ipc2BCl (2 equiv)sparteine (1 equiv)

pentane, -131 ¡ãC

OB(Ipc)2

Me

N

NH

H

HH

(-)-sparteine

BCl

Ipc2BCl2

O

tBu

Me Me

OH N3

1. BF3¡¤OEt2

2. NaHCO3

N

OOH

Me Me

But

1. PCC2. NaH

NH

O

But

Ph

O

tBuCHO, O2

cat. * (1 mol%)O

O

OO

O

Ph O2N O

ON NO2O

ON

Cu

cat. *:

1997, Bolm:

1995, Aubé:

1998, Ward:

Page 26: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Baeyer-Villiger Oxidations by Transition Metal Catalysis

N N

O OCr

IF

F

F

F

N N

O OZr

Y

PhPh

YY = PhO

R

O OO

R

A

B

*

B (5 mol%), UHP

CH2Cl2, r.t.

R

O OO

R *

A (5 mol%), H2O2

EtOH, 0 ¡ãC

R = Ph, 96%, 79% ee (4S)R = 4-ClC6H4, 82%, 75% ee (4S)R = 4-MeC6H4, 99%, 75% ee (4S)R = Me(CH2)7, 89%, 69% ee (4S)

R = 4-ClC6H4, 63%, 82% ee (4R)R = 4-MeC6H4, 43%, 84% ee (4R)R = Me(CH2)7, 63%, 81% ee (4R)

Uchida, T.; Katsuki, T.; Ito, K.; Akashi, S.; Ishii, A.; Kuroda, T. Helv. Chim. Acta 2002, 85, 3078-3089.

Watanabe, A.; Uchida, T.; Ito, K.; Katsuki, T. Tetrahedron Lett. 2002, 43, 4481-4485.

Page 27: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Baeyer-Villiger Oxidations by Organocatalysis

R

O OO

R *

cat. (10 mol%), H2O2-30 ¡ãC, 6 d

AcONa (cat.),CF3CH2OH/MeOH/H2O

H

N

N

NN

NOMe

O

Et

H

NN

NO

OMe

Et

2ClO4

NN

EtN

O

NMe

O

OOH

N

O H

entry R yield (%) % ee

1 4-MeOC6H4 67 61(+)

2 4-MeC6H4 53 62(+)

3 Ph 67 63(S)

4 4-BrC6H4 28 68(+)

5 4-ClC6H4 34 66(S)

6 4-FC6H4 55 65(+)

Murahashi, S.-I.; Ono, S.; Imada, Y. Angew. Chem. Int. Ed. 2002, 41, 2366-2368.

Page 28: Recent Developments and Applications in Enantioselective Desymmetrisation

Rhodium-Catalyzed Desymmetrisation of 4-Alkynals

M

M

O

H

M

O

H

H

O

M: metal complex

trans addition of M-Hto an alkyne

O

HH

O O

R

OMe

R

10 mol%[Rh((R)-Tol-BINAP)]BF4

CH2Cl2, 10 ¡ãC

R

OMe

R

entry R yield (%) % ee

1 n-C5H11 95 92

2 Cy 94 95

3 (CH2)3Cl 91 91

4 CH2OMe 93 82

Tanaka, K.; Fu, G. C. J. Am. Chem. Soc. 2002, 124, 10296-10297.

P(Tol)2

P(Tol)2

(R)-Tol-BINAP

Page 29: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Reduction of 2-Alkyl-1,3-diketones

R R

O O

R'

cat, (5 mol%)NaBH4, EtOH, THFA

CHCl3, 0 ¡ãC, 10hR R

OH O

R'N N

O OCo

O

Me Me

O

OH O OH OOH O

anti-selectivity: 99%,yield: 93%, ee: 99%

anti-selectivity: 99%,yield: 97%, ee: 99%

anti-selectivity: 99%,yield: 73%, ee: 99%

OH O

Br Br

anti-selectivity: 99%,yield: 68%, ee: 99%

OH O OH O

MeO OMe

anti-selectivity: 99%,yield: 96%, ee: 97%

anti-selectivity: 99%,yield: 88%, ee: 99%

OH O OH O OH O

Ph

anti-selectivity: 99%,yield: 45%, ee: 91%

anti-selectivity: 98%,yield: 88%, ee: 97%

anti-selectivity: 99%,yield: 96%, ee: 98%

Ohtsuka, Y.; Koyasu, K.; Ikeno, T.; Yamada, T. Org. Lett. 2001, 3, 2543-2546.

Page 30: Recent Developments and Applications in Enantioselective Desymmetrisation

Synthesis of a Potential Intermediate for Pseudomonic Acid B

BnO OBn

OTBS

BnO OBn

O

O O

BA

BnO OBn

OTMS

O O

Ph NLi

Ph

Me Me

TMSClTHF, -78 ¡ãC

C

BnO OBn

O O

HO2C OH

1. O3, MeOH/CH2Cl22. PPh3

3. NaBH4, MeOH

D92% yield from B

O

OBnO

O

MeO2C

O

OBnO

O

MeO2C

+

1. MeI, K2CO3, DMF

2. NaHMDS, THF

E

F

O

OBnHO

OH

MeO2C

O

OBnO

OH

O

p-TsOH, MeOHG

H

67% yield

24% yield

+

O

HO

OH

OHRO2C

OOH

R = (CH2)8CO2H

Psedomonic acid B

Honda, T.; Kimura, N. Org. Lett. 2002, 4, 4567-4570.

Page 31: Recent Developments and Applications in Enantioselective Desymmetrisation

1987, Schreiber:

1996, Landais:

1990, Ito:

MeMe

OH

OMe

OH

Me

(-)-DIPT, Ti(OiPr)4

tBuOOH

after 1.5 h, 99.3% ee, 99% de

SiMe2OH SiMe2OH

OH

OH

K2OsO2(OH)4, K2CO3K3Fe(CN)6, tBuOH/H2O

(DHQ)2PYR, 0 ¡ãC

80%, 65% ee, >98% de

Me Me

OSi

H

R R

[RhCl(C2H4)2]2 (2 mol%)

ClCH2CH2Cl30 ¡ãC, 11 d

Me Me

O SiR2O O

Me Me

Ph2P PPh2

ligand (3 mol%) Me

OH OH

MeH2O2, KF

93% ee, 99% de66% yield from diene

(-)-DIPT

OH

OHO

O

OiPriPrO

N N

Ph

Ph

DHQQHD

(DHQ)2PYR

Enantioselective Desymmetrisation of Alkenes: Previous Work

Page 32: Recent Developments and Applications in Enantioselective Desymmetrisation

PhO

O

O

H

H

H

+ SnCl4

CH2Cl2,-78 ¡ãC to -30 ¡ãC

H

HH

OOR*

HHO

81% yieldsingle isomer

1985, Whitesell:

Me Me

OTBScat. (10 mol%)

CH2Cl20 ¡ãC

99% ee, >99% synMeO

O

O

H

+

Me

OTBS

OH

O

OMe

O

OTiCl2

ON2

Ocat. (1.0 mol%)

CH2Cl2reflux

OO

OO

HHH

H

endo exo

75% yield, 20:1 endo:exo, 94% ee (endo)

Rh Rh

NO

H

CO2Me1994, Martin:

1992, Mikami:

Enantioselective Desymmetrisation of Alkenes: Previous Work

Page 33: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Desymmetrisation of Alkenes: Previous Work

Enantioselective Desymmetrisation of Alkenes: Previous Work

Mo

N Me

PhMe

RR

OO

Me

Me

MeMe

MeMe

MeMeMe

Me

a: R = iPrb: R = Me

Me Me

O

Me Me

O

Me Me

O

O

Me Me

n-octyl

Ph

O

Me

HMe

O

Me

HMe

O

Me

n-octylMe

O

Me

Ph

Me

Substrate Catalyst(5 mol%)

a

b

b

b

Product % Yield % ee

86

83

28

91

93

99

50

82

1998, Schrock and Hoveyda:

Page 34: Recent Developments and Applications in Enantioselective Desymmetrisation

Preparation of Cyclic Amines Through Mo-Catalyzed Asymmetric RCM

NAr

cat. (5 mol%)

C6H6, 22 ¡ãC NAr

Me

Me

H

Mo

N Me

PhMe

OO

Me

Me

MeMe

MeMe

MeMeMe

Me

iPr iPr

a

Mo

N Me

PhMe

iPr

OO

Mes

Mes

iPr

b Mes = 2,4,6-Me3C6H2

entry Ar cat. yield (%) % ee

1 Ph a 78 98

2 p-OMePh a 81 97

3 p-BrPh a 81 98

4 o-OMePh b 77 84

5 o-BrPh b 90 82

Dolman, S. J.; Sattely, E. S.; Hoveyda, A. H.; Schrock, R. R. J. Am. Chem. Soc. 2002, 124, 6991-6997.

Page 35: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Ru-Catalyzed RCM

N N

Ph Ph

RuPh

Cl

ClPCy3

R

R

a: o-methylb: o-isopropyl

Seiders, T. J.; Ward, D. W.; Grubbs, R. H. Org. Lett. 2001, 3, 3225-3228.

Me Me

O

Me Me

O

Me Me

O

Me

HMe

O

Me

HMe

Me

substrate catalyst(5 mol%)

a

product convn (%) % ee

95961820

9182

23233839

8590

bab

+ NaI+ NaI

Me Me

O

O

Me

HMe 78

901735

entry

1234

ab

+ NaI+ NaI

ab

+ NaI+ NaI

56

78

Me

Page 36: Recent Developments and Applications in Enantioselective Desymmetrisation

N N

Ph Ph

Ru

X

iPr

iPr

X

O

H R

N N

Ph Ph

Ru

X

iPrX

O

R H

iPr

R =

S

O

Me

HMe

Me S Observed as Major Isomer

R

Seiders, T. J.; Ward, D. W.; Grubbs, R. H. Org. Lett. 2001, 3, 3225-3228.

Enantioselective Ru-Catalyzed RCM

Page 37: Recent Developments and Applications in Enantioselective Desymmetrisation

Mo

N Me

PhMe

RR

O

O

Me

Me

MeMe

MeMe

MeMeMe

Me

a: R = iPrb: R = Me

O O

=MLn

=MLn

ROM O O

LnM

O O

LnM

=MLn

O O

O

O

RCM

RCM

OO

MLn

=MLn

O O

Weatherhead, G. S.; Ford, J. G.; Alexanian, E. J.; Schrock, R. R.; Hoveyda, A. H. J. Am. Chem. Soc. 2000, 122, 1828-1829.

Tandem Catalytic Asymmetric ROM/RCM

Page 38: Recent Developments and Applications in Enantioselective Desymmetrisation

O

Substrate Catalyst

a

a

Product % Yield % ee

10

69

>98

92

O O

H H

O

H

H

O O

Me Me

OO

Me

Me

OO

H H

OO

Me Me

OO

H

H

OO

Me

Me

Convn. ofbicycle %

a

b

76 98

84 >98

73

_

20

10

Weatherhead, G. S.; Ford, J. G.; Alexanian, E. J.; Schrock, R. R.; Hoveyda, A. H. J. Am. Chem. Soc. 2000, 122, 1828-1829.

Tandem Catalytic Asymmetric ROM/RCM

Page 39: Recent Developments and Applications in Enantioselective Desymmetrisation

Desymmetrisation of Meso Bicyclic Hydrazines by Enantioselective Hydroboration

NN R

RN

N RR

HO

+

RN=NR

CH2Cl2, 0 ¡ãC quantitative

CatBH (2 equiv), DME1 mol% [Rh(COD)Cl]2

2 mol% ligand*-50 ¡ãC, 30 min

entry R yield (%) % ee

1 CO2Et 49 83

2 CO2Bn 90 84

3 CO2Bu 58 80

4 -CONPhCO- 78 60

P P

(S,S)-DBPP

Luna, A. P.; Ceschi, M. A.; Bonin, M.; Micouin, L.; Husson, H. P.; Gougeon, S.; Estenne-Bouhtou,

G.; Marabout, B.; Sevrin, M.; George, P. J. Org. Chem. 2002, 67, 3522-3524.

Page 40: Recent Developments and Applications in Enantioselective Desymmetrisation

OH

NN CO2Bn

CO2Bn

HOPhH2CON NCOPh

OH

H H

NN CO2Bn

CO2Bn

HO

NN CO2Bn

CO2Bn NN CO2Bn

CO2Bn

PhH2CON NCOPh

OAc

H H

O

OAcN

N CO2BnCO2Bn

1. H2, CH3CO2H, Pt

2. PhCOCl, Py74%, 84% ee92% ee after one recryn.

oxalyl chloride

DMSO/Et3N, 84%

BH3¡¤THF, 76%

1. H2, CH3CO2H, Pt

2. PhCOCl, Py, 78%

Ac2O,Py/DMAP,82%

Luna, A. P.; Ceschi, M. A.; Bonin, M.; Micouin, L.; Husson, H. P.; Gougeon, S.; Estenne-Bouhtou,

G.; Marabout, B.; Sevrin, M.; George, P. J. Org. Chem. 2002, 67, 3522-3524.

Desymmetrisation of Meso Bicyclic Hydrazines by Enantioselective Hydroboration

Page 41: Recent Developments and Applications in Enantioselective Desymmetrisation

Asymmetric Synthesis of Polyhydroxylated Celastraceae Sesquiterpene Cores

O

AcOAcO

H

OAcO

OAc

OAcO

O

N

OOH

OOH

O

O

hypoglaunine B

O

HOHO

H

OHOH

X1

OH

X2

X4

X3 OH

RORO

OROR

OR

O OH

RORO

OROR

OR

epoxidativeenantioselective

desymmetrisationeuonyminol: X1, X2, X3, X4 = OH

4-hydroxyalatol: X1, X3 = OH, X2, X4 = H

14-deoxyalatol: X1, X2, X3, X4 = H

Spivey, A. C.; Woodhead, S. J.; Weston, M.; Andrews, B. I. Angew. Chem. Int. Ed. 2001, 40, 769-771.

Page 42: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Desymmetrisation of Meso-Decalin Diallylic Alcohols by Zr-Based SAE

O

OH

CN

OH

CN

O O

Et2AlCN,CH2Cl2,

rt (98%)

VO(acac)2,tBuOOH,

CH2Cl2, 70 ¡ãC(87%)

OBn

CN

O O

BnBr, NaHnBu4NI, NMP

50 ¡ãC (83%)

1. Ph3PBr2, rt,CH2Cl2 (87%)

2. TBSOTf,2,6-lutidine, rt,CH2Cl2 (98%)

3. DBU

50 ¡ãC (83%)

OBn

CN

TBSO OTBSOBn

CN

TBSO OTBS

OO O

O

1. OsO4, NMO (79%)

2. Me2C(OMe)2, TSOH/CH2Cl2 (95%)

3. K2OsO2(OH)4, K3Fe(CN)6, Base (74%)

4. Me2C(OMe)2, TSOH/CH2Cl2 (98%)

1. Na/NH3,THF, then,TBAF/THF (91%)

OH

CNO

O OO

2. MsCl, EtN3, CH2Cl2 (99%)

3. DBN, C7H8 (67%)

OH

CNO

O OO

O

enantioselectivedesymmetrisation

Ti(OiPr)4¡¤iPrOH/(L)-DIPT:

Zr(OiPr)4¡¤iPrOH/(L)-DIPT:

Zr(OiPr)4¡¤iPrOH/(D)-DIPT: 44% (55%), >95% ee

59% (74%), >95% ee

40%, 14% ee

(+) PDT

(-) PDT

Spivey, A. C.; Woodhead, S. J.; Weston, M.; Andrews, B. I. Angew. Chem. Int. Ed. 2001, 40, 769-771.

Page 43: Recent Developments and Applications in Enantioselective Desymmetrisation

R

OH

OH

R

cat. (0.5 mol%)BzCl, Et3N,

CH2Cl2, -78 ¡ãC

R

OBz

OH

RN

Me

N

Me

Bn73-85% yield60-96% ee

Me Me

MeMe

OH OH

Me Me

MeMe

OH OAccat. (1 mol%)Ac2O, Et3N,

t-amyl alcohol, 0 ¡ãC

FeN

Ph Ph

PhPh

Ph

Me2N

91% yield99.7% ee

OBz

OBz

ligand (0.75 mol%)[C3H5PdCl]2 (0.25 mol%)

TMS-N3, THF, 0 ¡ãC

OBz

N3

88% yield>95% ee

NH HNO O

PPh2 Ph2P

1998, Oriyama:

1998, Fu:

1996, Trost:

Enantioselective Desymmetrisation of Diols: Previous Work

Page 44: Recent Developments and Applications in Enantioselective Desymmetrisation

R

OH

OH

R

Me

CHO

PPTS

Me

O O

H

R R

NBS, MeOHcollidine

Me

OO

MeO

RR

Br

1. Zn, MgBr2¡¤Et2O

2.BnBr, NaH

Me

MeO

R R

O

H

H

OBn

PPTS R

OBn

OH

R

59-64% yield>99% ee

+

1997, Fujioka:

Me

OH

OH

Me

PhC¦®CCH(OEt)2O O

Me Me

Ph

NH

BOO

Bn

Ph

(1.2 equiv)

O

StBu

TMS(1.5 equiv)

CH2Cl2, -78 ¡ãC

Me

O OH

Me

COStBu

Ph

97%, 96% ee

1. MEMCl

2. LDA

Me

OH

OMEM

Me

1997, Harada:

Enantioselective Desymmetrisation of Diols: Previous Work

Page 45: Recent Developments and Applications in Enantioselective Desymmetrisation

Pd-Catalyzed Enantioselective Oxidation

OH

R1R R1R

OH

R1R

O+

5 mol% Pd(II), DCE, O2

20 mol% (-)-sparteine N

NH

H

HH

(-)-sparteine66-99% ee, krel =7.6-23.6

Ph Ph

OHOH10 mol% Pd(MeCN)2Cl2, DCE, O2

20 mol% (-)-sparteine, 60 ¡ãC

69% yield, 82% eePh Ph

OOH

Jensen, D. R.; Pugsley, J. S.; Sigman, M. S. J. Am. Chem. Soc. 2001, 123, 7475-7476.

Page 46: Recent Developments and Applications in Enantioselective Desymmetrisation

Asymmetric Oxidation of Meso-Diols under Photo-Irradiation

OH

OH(CH2)n (CH2)n O

Ocat. (2.0 mol%)

h, rt, CHCl3

PDA

CH2Cl2(CH2)n O

OH

N N

O O

Ru

Cl

Me MeNO

Ph Ph

R

R

a: n = 2b: n = 3c: n = 5

OHOH

d:

entry substrate yield (%) % ee confign

1 a 49 59 1R, 4S

2 b 57 65 1R, 5S

3 c 64 63 -

4 d 66 66 1R, 6S

Shimizu, H.; Nakata, K.; Katsuki, T. Chem. Lett. 2002, 1080-1081.

Page 47: Recent Developments and Applications in Enantioselective Desymmetrisation

Enantioselective Desymmetrisation of Meso Cyclic Allylic Bisdiethylphosphate

O OP(OEt)2

O

(EtO)2P

O

OP(OEt)2

O

O(EtO)2P

O

+

1. (CuOTf)2¡¤C6H6 (10 mol%)

ligand (10 mol%)toluene/THF (95:5) rt

2. Et2Zn (1.1 equiv) -78 ¡ãC a b

N

R1

SO O

NHR2

R3 OH

entry R1 R2 R3 a/b yield (%)

1 iBu CHPh2 3-Ph 94:6 54

2 iBu CHPh2 3,5-Cl2 94:6 47

3 iBu CHPh2 3,5-tBu2 87:13 42

4 Me CHPh2 3,5-Cl2 86:14 62

5 iBu CHPh2 H 84:16 54

6 iBu CHPh2 5,6-(CH)4- 83:17 49

7 Me CHPh2 H 31:69 13

8 iPr CHPh2 H 30:70 12

9 tBu (R)-CH(Me)Cy H 24:76 26

Piarulli, U.; Daubos, P.; Claverie, C; Roux, M; Gennari, C. Angew. Chem. Int. Ed. 2003, 42, 234-236.

Page 48: Recent Developments and Applications in Enantioselective Desymmetrisation

Pd-Catalyzed Enantioselective Ring Opening with Dialkylzinc

OPd(CH3CN)2Cl2 (5 mol%), L*

R2Zn (1.5 equiv), CH2Cl2, rt

R1

R1

R2

R2

R1

R1

R2

R2

OH

R

R = Et, L* = (R)-Tol-BINAPR = Me, L* = (S)-i-Pr-POX

entry R R1 R2 yield (%)

% ee

1 Me H F 87 90

2 Me Me Br 67 90

3 Me Me H 76 89

4 Me H O(CH2)O 85 91

5 Et H F 89 92

6 Et H O(CH2)O 91 92Pd

R1

R1

R2

R2

O

P

P*

Pd

R1

R1

R2

R2

P

P*O

Zn

Lautens, M.; Renaud, J.-L.; Hiebert, S. J. Am. Chem. Soc. 2000, 122, 1804-1805.

P(Tol)2

P(Tol)2

(R)-Tol-BINAP

PPh2 N

O

(S)-i-Pr-POX

Page 49: Recent Developments and Applications in Enantioselective Desymmetrisation

Rh-Catalyzed Enantioselective Ring Opening with Organoboronic Acids

OO

O

OH

O

OX

B(OH)2

X(1.2 equiv)

[Rh(COD)Cl]2 (2.5 mol%),(R)-(S)-PPF-P(t-Bu)2 (5 mol%),

Cs2CO3 in H2O (0.5 equiv), THF, rt

Fe

Ph2P

(t-Bu)2P

(R)-(S)-PPF-P(t-Bu)2

entry X yield (%) % ee

1 4-Me 88 95

2 None 91 95

3 2-Me n.r. -

4 4-Cl 95 95

5 3-Cl 73 99

6 2-Cl n.r. -

7 3-I 85 95

8 4-Ac 71 94

9 4-OMe 87 96

10 3-OMe 91 95

Rh

P

P

Ar O* +

O

Rh ArPP

*

O

Ar

RhP

P*

Lautens, M.; Dockendorff, C.; Fagnou, K.; Malicki, A. Org. Lett. 2002, 4, 1311-1314.

Page 50: Recent Developments and Applications in Enantioselective Desymmetrisation

Desymmetrisation of Diols with a Dinuclear Zinc Asymmetric Catalyst

ROH

OH O Ph

O

+OCOPh

OHR

H

5-10 mol% ligand10-20 mol% Et2Zn

toluene, -15 ¡ãC

OCOPh

OH

HOCOPh

OH

H OCOPh

OH

H OCOPh

OH

H

OCOPh

OH

H OCOPh

OH

HOCOPh

OH

H OCOPh

OH

H

OCOPh

OH

H

Me

S

S

OCOPh

OHMe

H OCOPh

OH

94%, 91% ee 98%, 91% ee 99%, 93% ee 89%, 90% ee

88%, 74% ee97%, 93% ee99%, 59% ee83%, 86% ee

78%, 70% ee 89%, 82% ee 93%, 91% ee

MeO Cl

Ph

Trost, B. M.; Mino, T. J. Am. Chem. Soc. ASAP

OHNN

OH HO

PhPh

Ph Ph

ONN

O O

ArAr

Ar ArZnZn

OOHOH

R H

Page 51: Recent Developments and Applications in Enantioselective Desymmetrisation

Summary

Previous works on the enantioselective desymmetrisation have been introduced briefly according to different functional groups

Recent developments in the enantioselective desymmetrisation have been surveyed based on different functional groups

Recent applications of enantioselective desymmetrisation in natural products synthesis have been shown

Page 52: Recent Developments and Applications in Enantioselective Desymmetrisation

Acknowledgement

Dr. Jeffrey Johnson

Johnson group