HRID303301

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID15908

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

C8H17N3

HCID70789

Benzenesulfonamide, p-methoxy- (6CI,7CI,8CI)

C7H9NO3S

结构：O=C(O)c1cc(C(=O)O)c(C(=O)N(Cc2cccc(Oc3ccccc3)c2)C2CCCc3ccccc32)cc1C(=O)O

HCID22608122

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(S(=O)(=O)NC(=O)c2cc(C(=O)O)c(C(=O)N(Cc3cccc(Oc4ccccc4)c3)C3CCCc4ccccc43)cc2C(=O)O)cc1

HCID178492903

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-50d99f63457f49ddb71b4452bd995e4b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:75]1[O:76][CH2:77][CH2:78][CH2:79]1.[CH3:43][O:44][c:45]1[cH:46][cH:47][c:48]([S:51](=[O:52])(=[O:53])[NH2:54])[cH:49][cH:50]1.[CH3:55][CH2:56][N:57]=[C:58]=[N:59][CH2:60][CH2:61][CH2:62][N:63]([CH3:64])[CH3:65].[CH3:66][N:67]([c:68]1[cH:69][cH:70][n:71][cH:72][cH:73]1)[CH3:74].[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][c:10]([CH2:11][N:12]([C:13](=[O:14])[c:15]2[c:16]([C:27](=[O:28])[OH:29])[cH:17][c:18]([C:24](=[O:25])[OH:26])[c:19]([C:21](=[O:22])[OH:23])[cH:20]2)[CH:30]2[CH2:31][CH2:32][CH2:33][c:34]3[cH:35][cH:36][cH:37][cH:38][c:39]32)[cH:40][cH:41][cH:42]1>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][c:10]([CH2:11][N:12]([C:13](=[O:14])[c:15]2[c:16]([C:27](=[O:28])[OH:29])[cH:17][c:18]([C:24](=[O:25])[NH:54][S:51]([c:48]3[cH:47][cH:46][c:45]([O:44][CH3:43])[cH:50][cH:49]3)(=[O:52])=[O:53])[c:19]([C:21](=[O:22])[OH:23])[cH:20]2)[CH:30]2[CH2:31][CH2:32][CH2:33][c:34]3[cH:35][cH:36][cH:37][cH:38][c:39]32)[cH:40][cH:41][cH:42]1