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Hydroxide → 3-({5-[2-(Pyridin-2-ylamino)-ethylcarbamoyl]-thiophene-2-carbonyl}-amino)-2-(2,4,6-trimethyl-benzenesulfonylamino)-propionic acid

HRID 1569793
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인쇄 미리보기

반응식

HRID 1569793 반응식
[CH3:1][O:2][C:3]([CH:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]1[s:10][c:11]([C:14]([NH:15][CH2:16][CH2:17][NH:18][c:19]2[n:20][cH:21][cH:22][cH:23][cH:24]2)=[O:25])[cH:12][cH:13]1)[NH:26][S:27](=[O:28])(=[O:29])[c:30]1[c:31]([CH3:38])[cH:32][c:33]([CH3:37])[cH:34][c:35]1[CH3:36])=[O:39].[CH3:42][C:43]#[N:44].[Li+:40].[OH-:41]>>[O:2]=[C:3]([CH:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]1[s:10][c:11]([C:14]([NH:15][CH2:16][CH2:17][NH:18][c:19]2[n:20][cH:21][cH:22][cH:23][cH:24]2)=[O:25])[cH:12][cH:13]1)[NH:26][S:27](=[O:28])(=[O:29])[c:30]1[c:31]([CH3:38])[cH:32][c:33]([CH3:37])[cH:34][c:35]1[CH3:36])[OH:39]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 961HydroxideHCID 6342AcetonitrileHCID 28486Lithium ionHCID 537556273-({5-[2-(Pyridin-2-ylamino)-ethylcarbamoyl]-thiophene-2-carbonyl}-amino)-2-(2,4,6-trimethyl-benzenesulfonylamino)-propionic acid methyl ester

생성물 1

HCID 698008343-({5-[2-(Pyridin-2-ylamino)-ethylcarbamoyl]-thiophene-2-carbonyl}-amino)-2-(2,4,6-trimethyl-benzenesulfonylamino)-propionic acid

출처 및 근거

ORD 기록
ord-ca01fae6fbe2465db9642676e68758e8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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