1,2-Dimethylindole-3-carboxylic acid → HCID 178433027, 화합물
반응식
[CH3:24][n:25]1[c:26]([CH3:37])[c:27]([C:34](=[O:35])[OH:36])[c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]12.[NH2:1][CH2:2][CH:3]1[N:4]([C:9](=[O:10])[c:11]2[n:12][c:13]([CH3:23])[s:14][c:15]2-[c:16]2[cH:17][c:18]([F:22])[cH:19][cH:20][cH:21]2)[CH:5]2[CH2:6][CH:7]2[CH2:8]1>>[NH:1]([CH2:2][CH:3]1[N:4]([C:9](=[O:10])[c:11]2[n:12][c:13]([CH3:23])[s:14][c:15]2-[c:16]2[cH:17][c:18]([F:22])[cH:19][cH:20][cH:21]2)[CH:5]2[CH2:6][CH:7]2[CH2:8]1)[C:34]([c:27]1[c:26]([CH3:37])[n:25]([CH3:24])[c:33]2[c:28]1[cH:29][cH:30][cH:31][cH:32]2)=[O:35]참가 물질
3
출처 및 근거
- ORD 기록
- ord-2d64584804124d5e95f839bff534df94
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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