Water → 1,2,3,4-Tetrahydro-2-(imidazol-1-yl)thiocarbonyl-3-(3,4-methylenedioxyphenyl)-9H-pyrrolo-[3,4-b]quinolin-9-one

HRID 1203847

반응식

HRID 1203847 반응식
[C:1](=[S:2])([n:3]1[cH:4][n:5][cH:6][cH:7]1)[n:8]1[cH:9][cH:10][n:11][cH:12]1.[CH2:13]1[O:14][c:15]2[cH:16][c:17]([CH:22]3[NH:23][CH2:24][c:25]4[c:26]3[nH:27][c:28]3[cH:29][cH:30][cH:31][cH:32][c:33]3[c:34]4=[O:35])[cH:18][cH:19][c:20]2[O:21]1.[O:36]=[CH:37][N:38]([CH3:39])[CH3:40].[OH2:41]>>[C:1](=[S:2])([n:3]1[cH:4][n:5][cH:6][cH:7]1)[N:23]1[CH:22]([c:17]2[cH:16][c:15]3[c:20]([cH:19][cH:18]2)[O:21][CH2:13][O:14]3)[c:26]2[c:25]([c:34](=[O:35])[c:33]3[c:28]([nH:27]2)[cH:29][cH:30][cH:31][cH:32]3)[CH2:24]1

참가 물질

5

출처 및 근거

ORD 기록
ord-6eed21984d6a4a0185fcfde702a0ba3c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

연결된 노트

불러오는 중…