Acetic Acid → HCID 178517217, 화합물

HRID 88174

반응식

HRID 88174 반응식
[C:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)(=[O:20])[N:21]1[CH2:22][CH2:23][CH:24]([C:27](=[O:28])[NH:29][NH2:30])[CH2:25][CH2:26]1.[CH3:31][C:32](=[O:33])[OH:34].[I:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[NH:7][C:6](=[O:11])[C:5]2=[O:12]>>[I:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[NH:7][C:6](=[O:11])[C:5]2=[N:30][NH:29][C:27]([CH:24]1[CH2:23][CH2:22][N:21]([C:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)=[O:20])[CH2:26][CH2:25]1)=[O:28]

참가 물질

4

출처 및 근거

ORD 기록
ord-f1a6bf8849b74d4c85efdb53f44b80c9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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