HRID802178

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID311

Citric Acid

C6H8O7

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID6228

Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID28123

Tetrahydroborate

H4B-

HCID80170

2,5-Pyrrolidinedione, 1-hydroxy-

C4H5NO3

反应SMILES：COc1ccc(C(=O)N2c3ccccc3C(n3c4ccccc4c4ccccc43)CC2CCCCC(=O)O)cc1OC

HCID22339253

未命名化合物

PRODUCTS

产物

反应SMILES：COc1ccc(C(=O)N2c3ccccc3C(n3c4ccccc4c4ccccc43)CC2CCCCCO)cc1OC

HCID22339233

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-fae7339bd40143e1975ca068c6a2cd3d
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应SMILES

[BH4-:63].[CH2:52]([N:53]=[C:54]=[N:55][CH2:56][CH2:57][CH2:58][N:59]([CH3:60])[CH3:61])[CH3:62].[CH3:83][N:84]([CH3:85])[CH:86]=[O:87].[ClH:51].[Na+:64].[O:78]1[CH2:79][CH2:80][CH2:81][CH2:82]1.[OH:43][N:44]1[C:45](=[O:46])[CH2:47][CH2:48][C:49]1=[O:50].[OH:65][C:66]([CH2:67][C:68]([C:69](=[O:70])[OH:71])([CH2:72][C:73](=[O:74])[OH:75])[OH:76])=[O:77].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]3[n:12]([CH:14]3[CH2:15][CH:16]([CH2:36][CH2:37][CH2:38][CH2:39][C:40](=[O:41])[OH:42])[N:17]([C:24]([c:25]4[cH:26][c:27]([O:33][CH3:34])[c:28]([O:31][CH3:32])[cH:29][cH:30]4)=[O:35])[c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]43)[c:13]12>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]3[n:12]([CH:14]3[CH2:15][CH:16]([CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][OH:41])[N:17]([C:24]([c:25]4[cH:26][c:27]([O:33][CH3:34])[c:28]([O:31][CH3:32])[cH:29][cH:30]4)=[O:35])[c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]43)[c:13]12