HRID95584

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID304

Cholest-5-en-3-ol

C27H46O

HCID6342

Acetonitrile

C2H3N

HCID10970

Butanedioyl dichloride

C4H4Cl2O2

HCID157350

Hydroxyl

HCID160419

Succinate

C4H4O4-2

PRODUCTS

产物

HCID500055

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-5b960580ea054626a6f894ee8abe3e45
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[C:29]([Cl:30])(=[O:31])[CH2:32][CH2:33][C:34]([Cl:35])=[O:36].[C:37]([CH2:38][CH2:39][C:40](=[O:41])[O-:42])(=[O:43])[O-:44].[CH3:1][CH:2]([CH3:3])[CH2:4][CH2:5][CH2:6][CH:7]([CH3:8])[CH:9]1[CH2:10][CH2:11][CH:12]2[CH:13]3[CH2:14][CH:15]=[C:16]4[CH2:17][CH:18]([OH:19])[CH2:20][CH2:21][C:22]4([CH3:23])[CH:24]3[CH2:25][CH2:26][C:27]12[CH3:28].[CH3:46][C:47]#[N:48].[OH:45]>>[CH3:1][CH:2]([CH3:3])[CH2:4][CH2:5][CH2:6][CH:7]([CH3:8])[CH:9]1[CH2:10][CH2:11][CH:12]2[CH:13]3[CH2:14][CH:15]=[C:16]4[CH2:17][CH:18]([O:19][C:37]([CH2:38][CH2:39][C:40](=[O:41])[OH:42])=[O:43])[CH2:20][CH2:21][C:22]4([CH3:23])[CH:24]3[CH2:25][CH2:26][C:27]12[CH3:28]