N-(4-Aminobenzoyl)-beta-alanine → HCID 66914398, 화합물

HRID 1545905

반응식

HRID 1545905 반응식
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[cH:10][n:11][c:12]2[c:13]([C:27]([F:28])([F:29])[F:30])[cH:14][cH:15][cH:16][c:17]2[c:18]1-[c:19]1[cH:20][c:21]([CH:22]=[O:23])[cH:24][cH:25][cH:26]1.[NH2:31][c:32]1[cH:33][cH:34][c:35]([C:36](=[O:37])[NH:38][CH2:39][CH2:40][C:41](=[O:42])[OH:43])[cH:44][cH:45]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[cH:10][n:11][c:12]2[c:13]([C:27]([F:28])([F:29])[F:30])[cH:14][cH:15][cH:16][c:17]2[c:18]1-[c:19]1[cH:20][c:21]([CH2:22][NH:31][c:32]2[cH:33][cH:34][c:35]([C:36](=[O:37])[NH:38][CH2:39][CH2:40][C:41](=[O:42])[OH:43])[cH:44][cH:45]2)[cH:24][cH:25][cH:26]1

참가 물질

3

출처 및 근거

ORD 기록
ord-636ca29b361b4ae7855e97d9b8ab55c9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

연결된 노트

불러오는 중…