HRID1150676

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID284

Formic acid

CH2O2

HCID7918

Acetic anhydride

C4H6O3

结构：CC(C)CCCC(C)C1CCC2C3CCC4CC(N)CCC4(C)C3CCC12C

HCID409821

10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine

C27H49N

PRODUCTS

生成物

结构：CC(C)CCCC(C)C1CCC2C3CCC4CC(NC=O)CCC4(C)C3CCC12C

HCID632867

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9271576e10bd42309412b7a63d2ac437
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:29][C:30](=[O:31])[O:32][C:33](=[O:34])[CH3:35].[CH:36]([OH:37])=[O:38].[NH2:1][CH:2]1[CH2:3][CH:4]2[CH2:5][CH2:6][CH:7]3[CH:8]4[CH2:9][CH2:10][CH:11]([CH:12]([CH2:13][CH2:14][CH2:15][CH:16]([CH3:17])[CH3:18])[CH3:19])[C:20]4([CH3:28])[CH2:21][CH2:22][CH:23]3[C:24]2([CH3:27])[CH2:25][CH2:26]1>>[NH:1]([CH:2]1[CH2:3][CH:4]2[CH2:5][CH2:6][CH:7]3[CH:8]4[CH2:9][CH2:10][CH:11]([CH:12]([CH2:13][CH2:14][CH2:15][CH:16]([CH3:17])[CH3:18])[CH3:19])[C:20]4([CH3:28])[CH2:21][CH2:22][CH:23]3[C:24]2([CH3:27])[CH2:25][CH2:26]1)[CH:30]=[O:31]