Hydrochloric Acid → 3-[2-(3-Hydroxypiperidin-1-yl)-4-oxo-8-[2-(4-propan-2-yl-1,3-thiazol-2-yl)ethenyl]pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoic acid

반응식

[CH2:39]1[O:40][CH2:41][CH2:42][O:43][CH2:44]1.[ClH:38].[OH:1][CH:2]1[CH2:3][N:4]([c:8]2[n:9][c:10]3[n:11]([c:12](=[O:23])[c:13]2[CH:14]=[CH:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[cH:24][cH:25][c:26]([CH:28]=[CH:29][c:30]2[s:31][cH:32][c:33]([CH:35]([CH3:36])[CH3:37])[n:34]2)[cH:27]3)[CH2:5][CH2:6][CH2:7]1>>[OH:1][CH:2]1[CH2:3][N:4]([c:8]2[n:9][c:10]3[n:11]([c:12](=[O:23])[c:13]2[CH:14]=[CH:15][C:16](=[O:17])[OH:18])[cH:24][cH:25][c:26]([CH:28]=[CH:29][c:30]2[s:31][cH:32][c:33]([CH:35]([CH3:36])[CH3:37])[n:34]2)[cH:27]3)[CH2:5][CH2:6][CH2:7]1

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 312751,4-Dioxane

HCID 178439808HCID 178439808, 화합물

생성물 1

HCID 696031713-[2-(3-Hydroxypiperidin-1-yl)-4-oxo-8-[2-(4-propan-2-yl-1,3-thiazol-2-yl)ethenyl]pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoic acid

출처 및 근거

ORD 기록: ord-791cec1c773c46f782449810cb30dcc2
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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