HRID208082

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID7397

p-Toluenesulfonyl chloride

C7H7ClO2S

反应SMILES：CC(CO)C1CCC2C3CC=C4CC(OC5CCCCO5)CC(OC5CCCCO5)C4(C)C3CCC12C

HCID178458140

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1ccc(S(=O)(=O)OCC(C)C2CCC3C4CC=C5CC(OC6CCCCO6)CC(OC6CCCCO6)C5(C)C4CCC23C)cc1

HCID178427719

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a44ca1033f8c400faacfba858035c52c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

[O:1]1[CH:2]([O:7][CH:8]2[CH2:9][CH:10]([O:31][CH:32]3[O:33][CH2:34][CH2:35][CH2:36][CH2:37]3)[CH2:11][C:12]3=[CH:13][CH2:14][CH:15]4[CH:16]5[CH2:17][CH2:18][CH:19]([CH:20]([CH2:21][OH:22])[CH3:23])[C:24]5([CH3:30])[CH2:25][CH2:26][CH:27]4[C:28]23[CH3:29])[CH2:3][CH2:4][CH2:5][CH2:6]1.[OH2:49].[c:38]1([CH3:48])[cH:39][cH:40][c:41]([S:44](=[O:45])(=[O:46])[Cl:47])[cH:42][cH:43]1.[cH:50]1[cH:51][cH:52][n:53][cH:54][cH:55]1>>[O:1]1[CH:2]([O:7][CH:8]2[CH2:9][CH:10]([O:31][CH:32]3[O:33][CH2:34][CH2:35][CH2:36][CH2:37]3)[CH2:11][C:12]3=[CH:13][CH2:14][CH:15]4[CH:16]5[CH2:17][CH2:18][CH:19]([CH:20]([CH2:21][O:22][S:44]([c:41]6[cH:40][cH:39][c:38]([CH3:48])[cH:43][cH:42]6)(=[O:45])=[O:46])[CH3:23])[C:24]5([CH3:30])[CH2:25][CH2:26][CH:27]4[C:28]23[CH3:29])[CH2:3][CH2:4][CH2:5][CH2:6]1