Acetic Acid → HCID 178474467, 화합물

HRID 317774

반응식

HRID 317774 반응식
[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[n:6][c:7]([OH:29])[c:8]2[c:9]([n:10]1)[n:11][cH:12][c:13]([CH:15]=[CH:16][c:17]1[cH:18][cH:19][c:20]([C:23](=[O:24])[O:25][C:26](=[O:27])[CH3:28])[cH:21][cH:22]1)[cH:14]2.[CH3:32][C:33](=[O:34])[OH:35].[Na+:31].[OH-:30].[OH2:36]>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[n:6][c:7]([OH:29])[c:8]2[c:9]([n:10]1)[n:11][cH:12][c:13]([CH:15]=[CH:16][c:17]1[cH:18][cH:19][c:20]([C:23](=[O:24])[OH:25])[cH:21][cH:22]1)[cH:14]2

참가 물질

6

출처 및 근거

ORD 기록
ord-2f10c0e040594711a5668c38e5f300cf
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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