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Hydrochloric Acid → {2-Chloro-4-[3-(4-chloro-phenylethynyl)-5-(3-morpholin-4-yl-propoxy)phenylsulfanyl]-phenoxy}-acetic Acid

HRID 1565981
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반응식

HRID 1565981 반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][O:6][c:7]1[c:8]([Cl:39])[cH:9][c:10]([S:13][c:14]2[cH:15][c:16]([C:30]#[C:31][c:32]3[cH:33][cH:34][c:35]([Cl:38])[cH:36][cH:37]3)[cH:17][c:18]([O:20][CH2:21][CH2:22][CH2:23][N:24]3[CH2:25][CH2:26][O:27][CH2:28][CH2:29]3)[cH:19]2)[cH:11][cH:12]1)=[O:40].[CH3:44][CH2:45][OH:46].[ClH:43].[Na+:42].[OH-:41]>>[O:3]=[C:4]([CH2:5][O:6][c:7]1[c:8]([Cl:39])[cH:9][c:10]([S:13][c:14]2[cH:15][c:16]([C:30]#[C:31][c:32]3[cH:33][cH:34][c:35]([Cl:38])[cH:36][cH:37]3)[cH:17][c:18]([O:20][CH2:21][CH2:22][CH2:23][N:24]3[CH2:25][CH2:26][O:27][CH2:28][CH2:29]3)[cH:19]2)[cH:11][cH:12]1)[OH:40]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 67171771{2-Chloro-4-[3-(4-chloro-phenylethynyl)-5-(3-morpholin-4-yl-propoxy)phenylsulfanyl]-phenoxy}-acetic Acid Ethyl Ester

생성물 1

HCID 16036305{2-Chloro-4-[3-(4-chloro-phenylethynyl)-5-(3-morpholin-4-yl-propoxy)phenylsulfanyl]-phenoxy}-acetic Acid

출처 및 근거

ORD 기록
ord-3d92f1001b2141e8ad512314305d63d4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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