HRID665322

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1140

Toluene

C7H8

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

HCID77869

2,5-Furandione, dihydro-3-octyl-

C12H20O3

PRODUCTS

生成物

结构：CCCCCCCCC1CC(=O)N(NC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)C1=O

HCID15044325

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d34661fefb9c4e88a1e832f5cb00fb7b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH2:16][CH2:17][C:18](=[O:19])[NH:20][NH2:21])[cH:8][c:9]([C:12]([CH3:13])([CH3:14])[CH3:15])[c:10]1[OH:11].[CH2:22]([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH3:29])[CH:30]1[C:31](=[O:32])[O:33][C:34](=[O:36])[CH2:35]1.[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[OH2:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH2:16][CH2:17][C:18](=[O:19])[NH:20][N:21]2[C:31](=[O:32])[CH:30]([CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH3:29])[CH2:35][C:34]2=[O:33])[cH:8][c:9]([C:12]([CH3:13])([CH3:14])[CH3:15])[c:10]1[OH:11]