HRID836587

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID5281

Octadecanoic acid

C18H36O2

HCID7237

o-Xylene

C8H10

HCID8058

n-Hexane

C6H14

HCID9086

3-Aminopropanol

C3H9NO

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

HCID88389

Fenozan

C17H26O3

HCID3017740

N-(3-Hydroxypropyl)octadecanimidic acid

C21H43NO2

HCID3826051

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCCCCCCCCCCCC(=O)NCCCOC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

HCID20558490

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e8cc89c6f20f4d228d3aebe480acb90f
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:53]([CH3:54])([CH3:55])([CH3:56])[c:57]1[cH:58][c:59]([CH2:68][CH2:69][C:70](=[O:71])[OH:72])[cH:60][c:61]([C:64]([CH3:65])([CH3:66])[CH3:67])[c:62]1[OH:63].[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][C:18](=[O:19])[OH:20].[CH3:26][O-:27].[CH3:81][CH2:82][CH2:83][CH2:84][CH2:85][CH3:86].[NH2:21][CH2:22][CH2:23][CH2:24][OH:25].[Na+:28].[OH2:87].[OH:29][CH2:30][CH2:31][CH2:32][NH:33][C:34]([CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH3:51])=[O:52].[c:73]1([CH3:74])[c:75]([CH3:76])[cH:77][cH:78][cH:79][cH:80]1>>[O:29]([CH2:30][CH2:31][CH2:32][NH:33][C:34]([CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH3:51])=[O:52])[C:70]([CH2:69][CH2:68][c:59]1[cH:58][c:57]([C:53]([CH3:54])([CH3:55])[CH3:56])[c:62]([OH:63])[c:61]([C:64]([CH3:65])([CH3:66])[CH3:67])[cH:60]1)=[O:71]