部分構造検索

390334

CCCCCC(O)CCCOC(=O)c1ccccc1

4-hydroxy-nonyl benzoate

DOI: 10.6084/m9.figshare.5104873.v1

CN(C)Cc1ccc([C@H]2CC[C@H](OC(=O)Cc3ccc(Cl)cc3)CC2)cc1.Cl

trans-O-(4-Chlorophenylacetyl)-4-(4-dimethylaminomethylphenyl)-cyclohexanol-hydrochloride

DOI: 10.6084/m9.figshare.5104873.v1

CN(C)Cc1ccc([C@H]2CC[C@H](OC(=O)Cc3ccc(Cl)cc3)CC2)cc1.O=C([O-])C(O)C(O)C(=O)[O-]

trans-O-(4-Chlorophenylacetyl)-4-(4-dimethylaminomethylphenyl)-cyclohexanol tartrate

DOI: 10.6084/m9.figshare.5104873.v1

CCCCC[C@H]1[C@@H](CC(=O)[O-])CC[C@H]1O

(1R,2S,3R)-3-hydroxy-2-pentyl-1-cyclopentaneacetate

DOI: 10.6084/m9.figshare.5104873.v1

C=C1C(CO)CC1OC(=O)c1ccccc1

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

CCCO[C@H]1CN[C@@H]([C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(=O)c2cccc(C(=O)NC(C)c3ccc(F)cc3)c2)C1

Reaction #49248

収率 84.0%DOI: 10.6084/m9.figshare.5104873.v1

CCCO[C@H]1CN[C@@H]([C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(=O)c2cccc(C(=O)NC(C)c3ccc(F)cc3)c2)C1

Reaction #49249

DOI: 10.6084/m9.figshare.5104873.v1

CCCCC[C@@H](O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O

Reaction #52122

(R)-3-hydroxyoctanoyl-CoA

DOI: 10.6084/m9.figshare.5104873.v1

$O=C(O)CCC/C=C\CC1C=CCCC1O$

Reaction #54588

7-(6-hydroxycyclohex-2-enyl)hept-5Z-enoic acid

収率 60.9%DOI: 10.6084/m9.figshare.5104873.v1

$O=C(O)CCC/C=C\CC1C=CCCC1=O$

Reaction #54589

7-(6-oxocyclohex-2-enyl)hept-5Z-enoic acid

収率 83.0%DOI: 10.6084/m9.figshare.5104873.v1

COc1ccc(OC2CCCN(C)CC2C)cc1

Reaction #56401

1,3-dimethyl-4-p-methoxyphenoxy-hexahydroazepine

DOI: 10.6084/m9.figshare.5104873.v1

CC(C)(C)OC(=O)NC1CCN(CC(c2ccc(Cl)c(Cl)c2)C2(O)CCCCC2)CC1

Reaction #57084

tert-butyl {1-[2-(3,4-dichlorophenyl)-2-(1-hydroxycyclohexyl)ethyl]piperidin-4-yl}carbamate

収率 53.0%DOI: 10.6084/m9.figshare.5104873.v1

CC(C(=O)OC1(C)CCCCC1)c1ccc(N)cc1

Reaction #62816

1-methylcyclohexyl 2-(p-aminophenyl)-propionate

収率 67.1%DOI: 10.6084/m9.figshare.5104873.v1

CC(C(=O)OC1(C)CCCCC1)c1ccc2nc(N)sc2c1

Reaction #62817

1-methylcyclohexyl 2-amino-α-methylbenzothiazole-6-acetate

収率 73.1%DOI: 10.6084/m9.figshare.5104873.v1

CC(C(=O)OC12CC3CC(CC(C3)C1)C2)c1ccc(N)cc1

Reaction #62819

1-adamantyl 2-(p-aminophenyl)propionate

収率 100.0%DOI: 10.6084/m9.figshare.5104873.v1

COC1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](N=[N+]=[N-])[C@H]1OCc1ccccc1

Reaction #72435

収率 78.0%DOI: 10.6084/m9.figshare.5104873.v1

CC(N)(c1ccccc1)C1CCC(Oc2cc3ccnc(OCc4ccccc4)c3cc2Cl)CC1

Reaction #73483

desired product

DOI: 10.6084/m9.figshare.5104873.v1

CCCO[C@@H]1[C@@H](Cc2ccc(C(F)(F)F)cc2)COC[C@H](NC(=O)c2nccc(OC)c2OCOC(=O)COCC)C(=O)O[C@H]1C

Reaction #87243

((4-methoxy-2-(((3S,7S,8R,9S)-9-methyl-2-oxo-8-propoxy-7-(4-(trifluoromethyl)benzyl)-1,5-dioxonan-3-yl)carbamoyl)pyridin-3-yl)oxy)methyl 2-ethoxyacetate

収率 93.0%DOI: 10.6084/m9.figshare.5104873.v1

C[C@H](CCC(=O)OCc1ccccc1)O[C@@H]1O[C@@H](C)[C@H](OC(=O)[C@H](C)CN=[N+]=[N-])C[C@H]1O

Reaction #90246

(R)-benzyl 4-(((2R,3R,5R,6S)-5-(((R)-3-azido-2-methylpropanoyl)oxy)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)pentanoate

収率 17.0%DOI: 10.6084/m9.figshare.5104873.v1

C[C@H](CCC(=O)OCc1ccccc1)O[C@@H]1O[C@@H](C)[C@H](OC(=O)[C@H](C)CN=[N+]=[N-])C[C@H]1OC(=O)CCCCO[C@@H]1O[C@@H](C)[C@H](OCc2ccccc2)C[C@H]1OCc1ccccc1

Reaction #90247

(2R,3R,5R,6S)-5-(((R)-3-azido-2-methylpropanoyl)oxy)-2-(((R)-5-(benzyloxy)-5-oxopentan-2-yl)oxy)-6-methyltetrahydro-2H-pyran-3-yl 5-(((2R,3R,5R,6S)-3,5-bis(benzyloxy)-6-methyltetrahydro-2H-pyran-2-yl)oxy)pentanoate

収率 97.0%DOI: 10.6084/m9.figshare.5104873.v1

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