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Bicarbonate Ion → N-(2-(2-(4-Hydroxy-4-(pyridin-4-yl)piperidin-1-yl)-2-oxoethoxy)ethyl)-4-methoxy-N,2,6-trimethylphenylsulfonamide

HRID 1557534
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인쇄 미리보기

반응식

HRID 1557534 반응식
[C:36](=[O:37])([OH:38])[O-:39].[CH2:41]([Cl:42])[Cl:43].[CH3:1][O:2][c:3]1[cH:4][c:5]([CH3:22])[c:6]([S:10](=[O:11])(=[O:12])[N:13]([CH3:14])[CH2:15][CH2:16][O:17][CH2:18][C:19](=[O:20])[OH:21])[c:7]([CH3:9])[cH:8]1.[Na+:40].[n:23]1[cH:24][cH:25][c:26]([C:29]2([OH:35])[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]2)[cH:27][cH:28]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH3:22])[c:6]([S:10](=[O:11])(=[O:12])[N:13]([CH3:14])[CH2:15][CH2:16][O:17][CH2:18][C:19](=[O:21])[N:32]2[CH2:31][CH2:30][C:29]([c:26]3[cH:25][cH:24][n:23][cH:28][cH:27]3)([OH:35])[CH2:34][CH2:33]2)[c:7]([CH3:9])[cH:8]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 6344DichloromethaneHCID 37269594-(4-Pyridinyl)-4-piperidinolHCID 46870354{2-[(4-methoxy-2,6-dimethyl-benzenesulfonyl)-methyl-amino]-ethoxy}acetic Acid

생성물 1

HCID 59820151N-(2-(2-(4-Hydroxy-4-(pyridin-4-yl)piperidin-1-yl)-2-oxoethoxy)ethyl)-4-methoxy-N,2,6-trimethylphenylsulfonamide

출처 및 근거

ORD 기록
ord-c6e16be97cf84da1bf8f72996c8dccc1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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