Ethanol → 2-(2-Benzoyl-phenylamino)-3-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-naphthalen-1-yl}-propionic acid

HRID 123074

반응식

HRID 123074 반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([O:17][CH2:18][CH2:19][c:20]2[n:21][c:22](-[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[o:23][c:24]2[CH3:25])[c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]12)[NH:32][c:33]1[c:34]([C:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)=[O:46])[cH:35][cH:36][cH:37][cH:38]1)=[O:47].[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH3:53][CH2:54][OH:55]>>[O:3]=[C:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([O:17][CH2:18][CH2:19][c:20]2[n:21][c:22](-[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[o:23][c:24]2[CH3:25])[c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]12)[NH:32][c:33]1[c:34]([C:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)=[O:46])[cH:35][cH:36][cH:37][cH:38]1)[OH:47]

참가 물질

4

반응물 3

HCID 702EthanolHCID 8028TetrahydrofuranHCID 695571212-(2-Benzoyl-phenylamino)-3-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-naphthalen-1-yl}-propionic acid ethyl ester

생성물 1

HCID 180034292-(2-Benzoyl-phenylamino)-3-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-naphthalen-1-yl}-propionic acid

출처 및 근거

ORD 기록
ord-9398fa5cb0674255a4e44d7916977214
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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