HRID93599

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID15413

Methyl tert-butyl ether

C5H12O

HCID28486

Lithium ion

Li+

HCID104727

Aluminum Cation

Al+3

HCID166653

Hydride

H-

4 次

结构：COc1c(C)c(C)c(OC)c(C(O)C2OC2(C)CCCC(C)CCCC(C)CCCC(C)C)c1C

HCID178490456

未命名化合物

PRODUCTS

生成物

结构：COc1c(C)c(C)c(OC)c(C(O)CC(C)(O)CCCC(C)CCCC(C)CCCC(C)C)c1C

HCID178490458

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-064dda1c804c42cc9f47c9d1f0f5ebce
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

[Al+3:37].[CH3:1][O:2][c:3]1[c:4]([CH:14]([CH:15]2[C:16]([CH2:17][CH2:18][CH2:19][CH:20]([CH2:21][CH2:22][CH2:23][CH:24]([CH2:25][CH2:26][CH2:27][CH:28]([CH3:29])[CH3:30])[CH3:31])[CH3:32])([CH3:33])[O:34]2)[OH:35])[c:5]([CH3:13])[c:6]([O:11][CH3:12])[c:7]([CH3:10])[c:8]1[CH3:9].[CH3:43][O:44][C:45]([CH3:46])([CH3:47])[CH3:48].[H-:36].[H-:39].[H-:40].[H-:41].[Li+:38].[OH2:42]>>[CH3:1][O:2][c:3]1[c:4]([CH:14]([CH2:15][C:16]([CH2:17][CH2:18][CH2:19][CH:20]([CH2:21][CH2:22][CH2:23][CH:24]([CH2:25][CH2:26][CH2:27][CH:28]([CH3:29])[CH3:30])[CH3:31])[CH3:32])([CH3:33])[OH:34])[OH:35])[c:5]([CH3:13])[c:6]([O:11][CH3:12])[c:7]([CH3:10])[c:8]1[CH3:9]