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Water → [3-[[1-(6-Chlorobenzothiazole-2-yl)pyrrolidine-3-ylamino]methyl]phenyl]acetic acid methyl ester

HRID 813642
노트
인쇄 미리보기

반응식

HRID 813642 반응식
[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7]([CH2:11][N:12]([S:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]2[N+:20]([O-:21])=[O:22])(=[O:23])=[O:24])[CH:25]2[CH2:26][N:27]([c:30]3[s:31][c:32]4[c:33]([n:34]3)[cH:35][cH:36][c:37]([Cl:39])[cH:38]4)[CH2:28][CH2:29]2)[cH:8][cH:9][cH:10]1)=[O:40].[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[OH2:51].[SH:41][CH2:42][C:43]([OH:44])=[O:45]>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7]([CH2:11][NH:12][CH:25]2[CH2:26][N:27]([c:30]3[s:31][c:32]4[c:33]([n:34]3)[cH:35][cH:36][c:37]([Cl:39])[cH:38]4)[CH2:28][CH2:29]2)[cH:8][cH:9][cH:10]1)=[O:40]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 962WaterHCID 1133Thioglycolic AcidHCID 6228DimethylformamideHCID 57966444HCID 57966444, 화합물

생성물 1

HCID 16117699[3-[[1-(6-Chlorobenzothiazole-2-yl)pyrrolidine-3-ylamino]methyl]phenyl]acetic acid methyl ester

출처 및 근거

ORD 기록
ord-27027420c4ea4f5b94065a146a6107c7
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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