HRID1575866

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID453

Hexitol

C6H14O6

HCID923

Sodium ion

Na+

2 次

HCID4149208

Dodecanoate anion

C12H23O2-

HCID4678093

Decanoic acid, ion(1-)

C10H19O2-

HCID5360545

Sodium

HCID5460308

Hydroxyacetate

C2H3O3-

PRODUCTS

生成物

HCID2969

Decanoic acid

C10H20O2

HCID3893

Dodecanoic acid

C12H24O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1f6dd987f2e3449b8d73ea53d57f158c
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:14]([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])(=[O:26])[O-:27].[CH2:29]([OH:30])[CH:31]([CH:32]([CH:33]([CH:34]([CH2:35][OH:36])[OH:37])[OH:38])[OH:39])[OH:40].[Na+:13].[Na+:28].[Na:41].[O-:1][C:2](=[O:3])[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12].[OH:42][CH2:43][C:44](=[O:45])[O-:46]>>[C:14]([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])(=[O:26])[OH:27].[O:1]=[C:2]([OH:3])[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12]