HRID116372

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6331

Borane

H3B

HCID5360545

Sodium

结构：CCn1nc(Nc2nc3c(cc(C(=O)N(C4CC4)C4CC4)n3CC)c3c2ncn3C)cc1C=O

HCID50991859

未命名化合物

PRODUCTS

生成物

HCID50991860

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c38856a28c3c4443bd125ea82c5876cb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[BH3:1].[CH3:37][OH:38].[CH:3]1([N:6]([C:7](=[O:8])[c:9]2[cH:10][c:11]3[c:12]([n:13][c:14]([NH:21][c:22]4[n:23][n:24]([CH2:29][CH3:30])[c:25]([CH:27]=[O:28])[cH:26]4)[c:15]4[c:16]3[n:17]([CH3:20])[cH:18][n:19]4)[n:31]2[CH2:32][CH3:33])[CH:34]2[CH2:35][CH2:36]2)[CH2:4][CH2:5]1.[Na:2]>>[CH:3]1([N:6]([C:7](=[O:8])[c:9]2[cH:10][c:11]3[c:12]([n:13][c:14]([NH:21][c:22]4[n:23][n:24]([CH2:29][CH3:30])[c:25]([CH2:27][OH:28])[cH:26]4)[c:15]4[c:16]3[n:17]([CH3:20])[cH:18][n:19]4)[n:31]2[CH2:32][CH3:33])[CH:34]2[CH2:35][CH2:36]2)[CH2:4][CH2:5]1