HRID165831

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6212

Chloroform

CHCl3

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID7582

Dicyclohexylamine

C12H23N

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID15908

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

C8H17N3

HCID78288

Glycine, N-[(1,1-dimethylethoxy)carbonyl]-

C7H13NO4

HCID337781

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NCC(=O)NCC(=O)NCC(=O)OCc1ccccc1

HCID434010

benzyl 2-[[2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]acetyl]amino]acetate

C18H25N3O6

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0b5d8cda878b4bb598dea243f446922c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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