HRID148068

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID7237

o-Xylene

C8H10

结构：CC(C)(C)c1cc(CCC(=O)NN)cc(C(C)(C)C)c1O

HCID64865

3-[3,5-DI(tert-butyl)-4-hydroxyphenyl]propanohydrazide

C17H28N2O2

HCID86876

Hexahydro-4-methylphthalic anhydride

C9H12O3

PRODUCTS

生成物

结构：CC1CCC2C(=O)N(NC(=O)CCc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)C(=O)C2C1

HCID19902401

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ea1e114fd31448989344f613805c5c15
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:13]([CH3:14])([CH3:15])([CH3:16])[c:17]1[cH:18][c:19]([CH2:28][CH2:29][C:30](=[O:31])[NH:32][NH2:33])[cH:20][c:21]([C:24]([CH3:25])([CH3:26])[CH3:27])[c:22]1[OH:23].[CH3:1][CH:2]1[CH2:3][CH:4]2[CH:5]([C:6](=[O:7])[O:8][C:9]2=[O:10])[CH2:11][CH2:12]1.[OH2:42].[c:34]1([CH3:35])[c:36]([CH3:37])[cH:38][cH:39][cH:40][cH:41]1>>[CH3:1][CH:2]1[CH2:3][CH:4]2[CH:5]([C:6](=[O:8])[N:33]([NH:32][C:30]([CH2:29][CH2:28][c:19]3[cH:18][c:17]([C:13]([CH3:14])([CH3:15])[CH3:16])[c:22]([OH:23])[c:21]([C:24]([CH3:25])([CH3:26])[CH3:27])[cH:20]3)=[O:31])[C:9]2=[O:10])[CH2:11][CH2:12]1