HRID1575449

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID993

Pentofuranose

C5H10O5

HCID7412

Benzoyl chloride

C7H5ClO

HCID8071

未命名化合物

HCID8471

Triethylamine

C6H15N

HCID8900

Heptane

C7H16

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID15413

Methyl tert-butyl ether

C5H12O

结构：CC1(OC(=O)c2ccccc2)C(O)OC(COC(=O)c2ccccc2)C1OC(=O)c1ccccc1

HCID22486074

未命名化合物

PRODUCTS

生成物

结构：CC1(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)OC(COC(=O)c2ccccc2)C1OC(=O)c1ccccc1

HCID22486087

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-670796db56c6483aa6ba33c5ab320c51
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)(=[O:18])[Cl:19].[C:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)(=[O:27])[O:28][C:29]1([CH3:54])[CH:30]([OH:31])[O:32][CH:33]([CH2:44][O:45][C:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)=[O:53])[CH:34]1[O:35][C:36]([c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)=[O:43].[CH3:55][CH2:56][N:57]([CH2:58][CH3:59])[CH2:60][CH3:61].[CH3:62][N:63]([c:64]1[cH:65][cH:66][n:67][cH:68][cH:69]1)[CH3:70].[CH3:71][O:72][CH2:73][CH2:74][O:75][CH3:76].[CH3:78][CH2:79][CH2:80][CH2:81][CH2:82][CH2:83][CH3:84].[CH3:85][O:86][C:87]([CH3:88])([CH3:89])[CH3:90].[OH2:77].[OH:1][CH:2]1[O:3][CH:4]([CH2:5][OH:6])[CH:7]([OH:8])[CH:9]1[OH:10]>>[C:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)(=[O:18])[O:31][CH:30]1[C:29]([O:28][C:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)=[O:27])([CH3:54])[CH:34]([O:35][C:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)=[O:43])[CH:33]([CH2:44][O:45][C:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)=[O:53])[O:32]1