Water → 3-Carbamoyl-1,2,4,5-tetrahydro-11-methyl-3H-azepino[4,5-b]quinoline

HRID 167170노트

반응식

HRID 167170 반응식
[CH3:1][c:2]1[c:3]2[c:4]([n:5][c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]13)[CH2:12][CH2:13][NH:14][CH2:15][CH2:16]2.[K:17][O:18][C:19]#[N:20].[OH2:21]>>[CH3:1][c:2]1[c:3]2[c:4]([n:5][c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]13)[CH2:12][CH2:13][N:14]([C:19](=[O:18])[NH2:20])[CH2:15][CH2:16]2

참가 물질

4

출처 및 근거

ORD 기록
ord-1fcf7749ba3b4277b90a8aebe3c17fb1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

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