4-Methoxy cinnamic acid → HCID 178490186, 화합물

HRID 205823

반응식

HRID 205823 반응식
[CH2:1]([CH:2]([CH3:3])[CH3:4])[N:5]([CH:6]([CH2:7][CH2:8][CH2:9][CH2:10][NH2:11])[C:12](=[O:13])[OH:14])[S:15](=[O:16])(=[O:17])[c:18]1[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][cH:23]1.[CH3:27][O:28][c:29]1[cH:30][cH:31][c:32]([CH:33]=[CH:34][C:35]([OH:36])=[O:37])[cH:38][cH:39]1>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[N:5]([CH:6]([CH2:7][CH2:8][CH2:9][CH2:10][NH:11][C:35]([CH:34]=[CH:33][c:32]1[cH:31][cH:30][c:29]([O:28][CH3:27])[cH:39][cH:38]1)=[O:36])[C:12](=[O:13])[OH:14])[S:15](=[O:16])(=[O:17])[c:18]1[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][cH:23]1

참가 물질

3

출처 및 근거

ORD 기록
ord-7791cc462cbd4dd5aa29c82dae2f0b0a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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