2-Methyl-3-phenylprop-2-enoic acid → HCID 68773887, 화합물

HRID 111333

반응식

HRID 111333 반응식
[CH3:13][N:14]([CH:15]1[CH2:16][N:17]([c:20]2[s:21][c:22]3[c:23]([n:24]2)[cH:25][cH:26][c:27]([NH2:29])[cH:28]3)[CH2:18][CH2:19]1)[CH3:30].[CH3:1][C:2]([C:3](=[O:4])[OH:5])=[CH:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1>>[CH3:1][C:2]([C:3](=[O:5])[NH:29][c:27]1[cH:26][cH:25][c:23]2[c:22]([s:21][c:20]([N:17]3[CH2:16][CH:15]([N:14]([CH3:13])[CH3:30])[CH2:19][CH2:18]3)[n:24]2)[cH:28]1)=[CH:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1

참가 물질

3

출처 및 근거

ORD 기록
ord-2944d7517ae747ce9989118671fbba6d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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