部分構造検索

C=O

CCNC(=O)Nc1nc2c(s1)C(=O)CCC2

収率 85.0%DOI: 10.6084/m9.figshare.5104873.v1

C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O

Reaction #50911

収率 15.0%DOI: 10.6084/m9.figshare.5104873.v1

COc1cccc(-c2ccc3c(c2)NC(=O)C3=Cc2[nH]c3c(c2CCC(=O)O)CCCC3)c1

Reaction #52793

3-{2-[6-(3-methoxyphenyl)-2-oxo-1,2-dihydroindol-3-ylidenemethyl]-4,5,6,7-tetrahydro-1H-indol-3-yl}-propionic acid

収率 82.1%DOI: 10.6084/m9.figshare.5104873.v1

COc1ccc(-c2ccc3c(c2)NC(=O)C3=Cc2[nH]c3c(c2CCC(=O)O)CCCC3)cc1

Reaction #52794

3-{2-[6-(4-Methoxyphenyl)-2-oxo-1,2-dihydroindol-3-ylidenemethyl]-4,5,6,7-tetrahydro-1H-indol-3-yl}-propionic acid

収率 30.0%DOI: 10.6084/m9.figshare.5104873.v1

O=C(O)CCc1c(C=C2C(=O)Nc3cc(-c4ccccc4)ccc32)[nH]c2c1CCCC2

Reaction #52795

3-[2-(2-oxo-6-phenyl-1,2-dihydro-indol-3-ylidenemethyl)-4,5,6,7-tetrahydro-1H-indol-3yl]-propionic acid

収率 33.3%DOI: 10.6084/m9.figshare.5104873.v1

CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@@H](COCc1ccccc1)C(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)O)[C@@H](C)OCc1ccccc1

Reaction #54611

Boc-Val-Asp(OBzl)-Thr(Bzl)-Ser(Bzl)-Ser(Bzl)-Glu(OBzl)-OH

DOI: 10.6084/m9.figshare.5104873.v1

COc1ccc2c(c1)C1(C)CC(=O)N(C)C1(O)CC2

Reaction #54673

3,9b-Dimethyl-3a-hydroxy-8-methoxy-2-oxo-2,3,3a,4,5,9b-hexahydro-1H-benz[e]indole

DOI: 10.6084/m9.figshare.5104873.v1

CC(=O)c1sc(N(C)C)nc1C

Reaction #60640

1-(2-dimethylamino-4-methyl-thiazol-5-yl)-ethanone

DOI: 10.6084/m9.figshare.5104873.v1

CC(=O)N(CC(O)COCCOCC(O)CN(C(C)=O)c1c(I)c(C(=O)N(CCO)CCO)c(I)c(C(=O)N(CCO)CCO)c1I)c1c(I)c(C(=O)N(CCO)CCO)c(I)c(C(=O)N(CCO)CCO)c1I

Reaction #70107

expected product

DOI: 10.6084/m9.figshare.5104873.v1

CCNC(=O)c1sc(NC(=O)c2ccc(Cc3ccccc3)cc2)nc1C

Reaction #73672

DOI: 10.6084/m9.figshare.5104873.v1

Cc1nc(NC(=O)c2ccc(Cc3ccccc3)cc2)sc1C(=O)NCCC#N

Reaction #73673

DOI: 10.6084/m9.figshare.5104873.v1

Reaction #92008

収率 28.0%DOI: 10.6084/m9.figshare.5104873.v1

$COc1ccc(CN2C(=O)CC[C@@H]2/C=C(\c2ccc(C(C)(C)C)cc2)c2ccc(C(C)OC(=S)SC)c(OC)n2)c(OC)c1$

Reaction #157836

O-[1-(6-{(E)-1-(4-tert-butylphenyl)-2-[(2R)-1-(2,4-dimethoxybenzyl)-5-oxopyrrolidin-2-yl]ethenyl}-2-methoxypyridin-3-yl)ethyl] S-methyl carbonodithioate

DOI: 10.6084/m9.figshare.5104873.v1

CCc1ccc(/C(=C/[C@H]2CCC(=O)N2Cc2ccc(OC)cc2OC)c2ccc(C(C)(C)C)cc2)nc1OC

Reaction #157837

(5R)-5-[(E)-2-(4-tert-butylphenyl)-2-(5-ethyl-6-methoxypyridin-2-yl)ethenyl]-1-(2,4-dimethoxybenzyl)pyrrolidin-2-one

収率 71.6%DOI: 10.6084/m9.figshare.5104873.v1

$COc1ccc(CN2C(=O)CC[C@@H]2/C=C(\c2ccc(C(C)(C)C)cc2)c2ccc(CCCCOS(C)(=O)=O)c(OC)n2)c(OC)c1$

Reaction #157846

4-(6-{(E)-1-(4-tert-butylphenyl)-2-[(2R)-1-(2,4-dimethoxybenzyl)-5-oxopyrrolidin-2-yl]ethenyl}-2-methoxypyridin-3-yl)butyl methanesulfonate

DOI: 10.6084/m9.figshare.5104873.v1

$COc1ccc(CN2C(=O)CC[C@@H]2/C=C(\c2ccc(C(C)(C)C)cc2)c2ccc(CCCCN(C)C)c(OC)n2)c(OC)c1$

Reaction #157847

(5R)-5-[(E)-2-(4-tert-butylphenyl)-2-{5-[4-(dimethylamino)butyl]-6-methoxypyridin-2-yl}ethenyl]-1-(2,4-dimethoxybenzyl)pyrrolidin-2-one

DOI: 10.6084/m9.figshare.5104873.v1

O=C(CCCN1C(=O)c2ccccc2C1=O)N1CCCC2=C1CCc1cc(Cl)ccc12

Reaction #173990

DOI: 10.1039/C8SC04228D

COC(=O)c1cnc(N2CCN(CCO)CC2)s1

Reaction #174651

DOI: 10.1039/C8SC04228D

Nc1nc2c(s1)CC(=O)CC2

Reaction #185330

DOI: 10.1039/C8SC04228D

CCOC(=O)c1sc(Cl)nc1C

Reaction #187218

DOI: 10.1039/C8SC04228D

1 ページ次のページ