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Hydrochloric Acid → {4-[3-(4-Fluoro-benzyloxy)-5-(3-morpholin-4-yl-prop-1-ynyl)-phenylsulfanyl]-2-methyl-phenoxy}-acetic Acid

HRID 1116291
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반응식

HRID 1116291 반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][O:6][c:7]1[c:8]([CH3:38])[cH:9][c:10]([S:13][c:14]2[cH:15][c:16]([O:29][CH2:30][c:31]3[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]3)[cH:17][c:18]([C:20]#[C:21][CH2:22][N:23]3[CH2:24][CH2:25][O:26][CH2:27][CH2:28]3)[cH:19]2)[cH:11][cH:12]1)=[O:39].[CH3:43][CH2:44][OH:45].[ClH:42].[Na+:41].[OH-:40]>>[O:3]=[C:4]([CH2:5][O:6][c:7]1[c:8]([CH3:38])[cH:9][c:10]([S:13][c:14]2[cH:15][c:16]([O:29][CH2:30][c:31]3[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]3)[cH:17][c:18]([C:20]#[C:21][CH2:22][N:23]3[CH2:24][CH2:25][O:26][CH2:27][CH2:28]3)[cH:19]2)[cH:11][cH:12]1)[OH:39]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 67170755{4-[3-(4-Fluoro-benzyloxy)-5-(3-morpholin-4-yl-prop-1-ynyl)-phenylsulfanyl]-2-methyl-phenoxy}-acetic Acid Ethyl Ester

생성물 1

HCID 16036309{4-[3-(4-Fluoro-benzyloxy)-5-(3-morpholin-4-yl-prop-1-ynyl)-phenylsulfanyl]-2-methyl-phenoxy}-acetic Acid

출처 및 근거

ORD 기록
ord-467eca5f626f487cb426913b87c200e7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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