Benzenepropanoic acid, 4-hydroxy-, methyl ester → Methyl 3-{4-[(4-{[(4-phenyl-1,3-thiazol-2-yl)(2-pyridin-2-ylethyl)amino]methyl}benzyl)oxy]phenyl}propanoate

반응식

[OH:30][c:31]1[cH:32][cH:33][c:34]([CH2:37][CH2:38][C:39](=[O:40])[O:41][CH3:42])[cH:35][cH:36]1.[c:1]1(-[c:7]2[n:8][c:9]([N:12]([CH2:13][CH2:14][c:15]3[n:16][cH:17][cH:18][cH:19][cH:20]3)[CH2:21][c:22]3[cH:23][cH:24][c:25]([CH2:28][OH:29])[cH:26][cH:27]3)[s:10][cH:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[n:8][c:9]([N:12]([CH2:13][CH2:14][c:15]3[n:16][cH:17][cH:18][cH:19][cH:20]3)[CH2:21][c:22]3[cH:23][cH:24][c:25]([CH2:28][O:29][c:31]4[cH:32][cH:33][c:34]([CH2:37][CH2:38][C:39](=[O:40])[O:41][CH3:42])[cH:35][cH:36]4)[cH:26][cH:27]3)[s:10][cH:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

참가 물질

반응물 2

HCID 79706Benzenepropanoic acid, 4-hydroxy-, methyl ester

HCID 23143295(4-([(4-Phenyl-1,3-thiazol-2-yl)(2-pyridin-2-ylethyl)amino]methyl}phenyl)methanol

생성물 1

HCID 23143288Methyl 3-{4-[(4-{[(4-phenyl-1,3-thiazol-2-yl)(2-pyridin-2-ylethyl)amino]methyl}benzyl)oxy]phenyl}propanoate

출처 및 근거

ORD 기록: ord-1022f9d310e345b9a2f10087c2245723
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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