Acetonitrile → 1-(2-((1-(Ethoxycarbonyl)butyl)amino)propionyl)octahydro-1H-indole-2-carboxylic acid

HRID 669283

반응식

HRID 669283 반응식
[Br:21][CH:22]([C:23](=[O:24])[N:25]1[CH:26]([C:34](=[O:35])[OH:36])[CH2:27][CH:28]2[CH2:29][CH2:30][CH2:31][CH2:32][CH:33]12)[CH3:37].[CH3:11][CH2:12][N:13]([CH2:14][CH3:15])[CH2:16][CH3:17].[CH3:18][C:19]#[N:20].[Cl:38][CH2:39][Cl:40].[NH2:1][CH:2]([C:3](=[O:4])[O:5][CH2:6][CH3:7])[CH2:8][CH2:9][CH3:10]>>[NH:1]([CH:2]([C:3](=[O:4])[O:5][CH2:6][CH3:7])[CH2:8][CH2:9][CH3:10])[CH:22]([C:23](=[O:24])[N:25]1[CH:26]([C:34](=[O:35])[OH:36])[CH2:27][CH:28]2[CH2:29][CH2:30][CH2:31][CH2:32][CH:33]12)[CH3:37]

참가 물질

6

출처 및 근거

ORD 기록
ord-32aa0401bb2d489c8cd142f16e7b2315
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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