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Hydrochloric Acid → 3-(4-{2-Oxo-3-[4-(3-o-tolyl-ureido)phenyl]-2H-pyridin-1-ylmethyl}phenyl)-propionic acid

HRID 2315326
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반응식

HRID 2315326 반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][c:7]1[cH:8][cH:9][c:10]([CH2:13][n:14]2[c:15](=[O:37])[c:16](-[c:20]3[cH:21][cH:22][c:23]([NH:26][C:27](=[O:28])[NH:29][c:30]4[c:31]([CH3:36])[cH:32][cH:33][cH:34][cH:35]4)[cH:24][cH:25]3)[cH:17][cH:18][cH:19]2)[cH:11][cH:12]1)=[O:38].[ClH:41].[Li+:39].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1.[OH-:40].[OH2:47]>>[O:3]=[C:4]([CH2:5][CH2:6][c:7]1[cH:8][cH:9][c:10]([CH2:13][n:14]2[c:15](=[O:37])[c:16](-[c:20]3[cH:21][cH:22][c:23]([NH:26][C:27](=[O:28])[NH:29][c:30]4[c:31]([CH3:36])[cH:32][cH:33][cH:34][cH:35]4)[cH:24][cH:25]3)[cH:17][cH:18][cH:19]2)[cH:11][cH:12]1)[OH:38]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104589693-(4-{2-Oxo-3-[4-(3-o-tolyl-ureido)phenyl)2H-pyridin-1-ylmethyl}phenyl)propionic acid ethyl ester

생성물 1

HCID 9848051
3-(4-{2-Oxo-3-[4-(3-o-tolyl-ureido)phenyl]-2H-pyridin-1-ylmethyl}phenyl)-propionic acid

출처 및 근거

ORD 기록
ord-a2cabccf97fe4299bb4ef02cfe8ebcd9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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