HRID2342299

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1118

Sulfuric acid

H2O4S

HCID6212

Chloroform

CHCl3

HCID6586

Methyl chlorocarbonate

C2H3ClO2

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

结构：CC(C)(C)OC(=O)NCCCC(NC(=O)OCc1ccccc1)C(=O)O

HCID333627

N-Cbz-N'-Boc-L-ornithine

C18H26N2O6

HCID10290764

1-Methyl-1H-pyrazole-4,5-diamine

C4H8N4

PRODUCTS

生成物

结构：Cn1ncc(NC(=O)C(CCCNC(=O)OC(C)(C)C)NC(=O)OCc2ccccc2)c1N

HCID178481891

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-17133ebc24f24feea8a6343f511a004c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]([C:13](=[O:14])[OH:15])[CH2:16][CH2:17][CH2:18][NH:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26].[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH3:44][n:45]1[n:46][cH:47][c:48]([NH2:51])[c:49]1[NH2:50].[CH:58]([Cl:59])([Cl:60])[Cl:61].[Cl:34][C:35]([O:36][CH3:37])=[O:38].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[OH2:57].[S:39]([OH:40])([OH:41])(=[O:42])=[O:43]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]([C:13](=[O:15])[NH:51][c:48]1[cH:47][n:46][n:45]([CH3:44])[c:49]1[NH2:50])[CH2:16][CH2:17][CH2:18][NH:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26]