Bicarbonate Ion → 6-(4-{2-[(3,5-Dimethyl-isoxazol-4-ylmethyl)-amino]-ethyl}-phenoxy)-nicotinamide

HRID 2152589

반응식

HRID 2152589 반응식
[C:1](=[O:2])([OH:3])[O-:4].[CH3:36][N:37]([CH3:38])[CH:39]=[O:40].[Cl:6][CH2:7][c:8]1[c:9]([CH3:14])[n:10][o:11][c:12]1[CH3:13].[NH2:15][CH2:16][CH2:17][c:18]1[cH:19][cH:20][c:21]([O:22][c:23]2[n:24][cH:25][c:26]([C:27](=[O:28])[NH2:29])[cH:30][cH:31]2)[cH:32][cH:33]1.[Na+:35].[Na+:5].[OH-:34]>>[CH2:7]([c:8]1[c:9]([CH3:14])[n:10][o:11][c:12]1[CH3:13])[NH:15][CH2:16][CH2:17][c:18]1[cH:19][cH:20][c:21]([O:22][c:23]2[n:24][cH:25][c:26]([C:27](=[O:28])[NH2:29])[cH:30][cH:31]2)[cH:32][cH:33]1

참가 물질

7

출처 및 근거

ORD 기록
ord-4b0361a84e3f4794b327751510884f88
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

연결된 노트

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