HRID1238389

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID1118

Sulfuric acid

H2O4S

HCID7918

Acetic anhydride

C4H6O3

结构：COC1OC(COC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1

HCID298316

Methyl 2,3,5-tri-O-benzoylpentofuranoside

C27H24O8

PRODUCTS

生成物

结构：CC(=O)OC1OC(COC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1

HCID229578

1-O-Acetyl-2,3,5-tri-O-benzoylpentofuranose

C28H24O9

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e321b5430eb4449685dd65061d62fd5b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH:10]1[CH:11]([O:12][CH3:13])[O:14][CH:15]([CH2:26][O:27][C:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)=[O:35])[CH:16]1[O:17][C:18]([c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)=[O:25].[CH3:36][C:37]([O:38][C:39](=[O:40])[CH3:41])=[O:42].[CH3:43][C:44]([OH:45])=[O:46].[OH2:58].[S:53](=[O:54])(=[O:55])([OH:56])[OH:57].[cH:47]1[cH:48][cH:49][n:50][cH:51][cH:52]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH:10]1[CH:11]([O:45][C:44]([CH3:43])=[O:46])[O:14][CH:15]([CH2:26][O:27][C:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)=[O:35])[CH:16]1[O:17][C:18]([c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)=[O:25]