HRID2156038

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID6431990

未命名化合物

结构：COCOc1c(-c2cc(C)cc(C)c2)cc(C(=O)O)cc1-c1cc(C)cc(C)c1

HCID22237554

未命名化合物

PRODUCTS

生成物

结构：COCOc1c(-c2cc(C)cc(C)c2)cc(C(=O)NCCCCCCCc2ccccc2)cc1-c1cc(C)cc(C)c1

HCID22237438

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-467d709ebac0405d928f6ce06e36dd6b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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