HRID90356

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)CCCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C

HCID304

Cholest-5-en-3-ol

C27H46O

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID6410

tert-Butyl hydroperoxide

C4H10O2

HCID61739

Hypochlorite

ClO-

PRODUCTS

生成物

结构：CC(C)CCCC(C)C1CCC2C3C(=O)C=C4CC(O)CCC4(C)C3CCC12C

HCID287664

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cfa85091216040b38545ca880e9ee9fb
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]([CH3:31])([CH3:32])([O:33][OH:30])[CH3:34].[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].[Cl:35][O-:36].[Cl:38][CH2:39][Cl:40].[Na+:37]>>[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[C:14](=[O:33])[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]