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Hydrochloric Acid → 4-[3-[3-[[5-[3,5-bis(trifluoromethyl)phenyl]-4-methyl-2-oxo-1,3-oxazolidin-3-yl]methyl]pyrazin-2-yl]-4-fluorophenyl]-3-methylbenzoic acid

HRID 2335277
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인쇄 미리보기

반응식

HRID 2335277 반응식
[CH2:51]1[O:52][CH2:53][CH2:54][O:55][CH2:56]1.[ClH:50].[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]2[CH:14]([CH3:44])[N:15]([CH2:19][c:20]3[c:21](-[c:26]4[cH:27][c:28](-[c:33]5[c:34]([CH3:43])[cH:35][c:36]([C:39](=[O:40])[O:41][CH3:42])[cH:37][cH:38]5)[cH:29][cH:30][c:31]4[F:32])[n:22][cH:23][cH:24][n:25]3)[C:16](=[O:18])[O:17]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:45])[F:46].[Li+:49].[OH-:48].[OH2:47]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]2[CH:14]([CH3:44])[N:15]([CH2:19][c:20]3[c:21](-[c:26]4[cH:27][c:28](-[c:33]5[c:34]([CH3:43])[cH:35][c:36]([C:39](=[O:40])[OH:41])[cH:37][cH:38]5)[cH:29][cH:30][c:31]4[F:32])[n:22][cH:23][cH:24][n:25]3)[C:16](=[O:18])[O:17]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:45])[F:46]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 961HydroxideHCID 962WaterHCID 28486Lithium ionHCID 312751,4-DioxaneHCID 178497507HCID 178497507, 화합물

생성물 1

HCID 178427229
4-[3-[3-[[5-[3,5-bis(trifluoromethyl)phenyl]-4-methyl-2-oxo-1,3-oxazolidin-3-yl]methyl]pyrazin-2-yl]-4-fluorophenyl]-3-methylbenzoic acid

출처 및 근거

ORD 기록
ord-9a73903f51e845ef8a7e6220a4b0d3e3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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