Ethanol → Cgp-74588

HRID 170518

반응식

HRID 170518 반응식
[CH2:1]1[CH2:2][NH:3][CH2:4][CH2:5][NH:6]1.[CH3:38][CH2:39][OH:40].[Cl:7][CH2:8][c:9]1[cH:10][cH:11][c:12]([C:13](=[O:14])[NH:15][c:16]2[cH:17][c:18]([NH:23][c:24]3[n:25][cH:26][cH:27][c:28](-[c:30]4[cH:31][n:32][cH:33][cH:34][cH:35]4)[n:29]3)[c:19]([CH3:22])[cH:20][cH:21]2)[cH:36][cH:37]1.[OH2:41]>>[CH2:1]1[CH2:2][N:3]([CH2:8][c:9]2[cH:10][cH:11][c:12]([C:13](=[O:14])[NH:15][c:16]3[cH:17][c:18]([NH:23][c:24]4[n:25][cH:26][cH:27][c:28](-[c:30]5[cH:31][n:32][cH:33][cH:34][cH:35]5)[n:29]4)[c:19]([CH3:22])[cH:20][cH:21]3)[cH:36][cH:37]2)[CH2:4][CH2:5][NH:6]1

참가 물질

5

출처 및 근거

ORD 기록
ord-6508bc6e639b4b5197393441412fa663
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

불러오는 중…