HRID1543620

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID51678

Demethyldeacetylmoxisylyte

C13H21NO2

HCID19957708

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：Cc1cc(OCCN(C)Cc2c(C)c(O)c(C)c(C)c2OCCO)c(C(C)C)cc1O

HCID19957660

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4124576018234cbf8a069a0de622d340
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

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