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Bicarbonate Ion → N-(2-chloro-4-hydroxy-benzyl)-N-[4-(3-hydroxy-propyl)-phenyl]-2,4,6-trimethyl-benzenesulfonamide

HRID 108039
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HRID 108039 반응식
[BH4-:33].[C:35](=[O:36])([OH:37])[O-:38].[CH2:42]([Cl:43])[Cl:44].[CH3:40][OH:41].[Cl:1][c:2]1[c:3]([CH2:4][N:5]([S:6](=[O:7])(=[O:8])[c:9]2[c:10]([CH3:17])[cH:11][c:12]([CH3:16])[cH:13][c:14]2[CH3:15])[c:18]2[cH:19][cH:20][c:21]([CH2:24][CH2:25][CH:26]=[O:27])[cH:22][cH:23]2)[cH:28][cH:29][c:30]([OH:32])[cH:31]1.[Na+:34].[Na+:39]>>[Cl:1][c:2]1[c:3]([CH2:4][N:5]([S:6](=[O:7])(=[O:8])[c:9]2[c:10]([CH3:17])[cH:11][c:12]([CH3:16])[cH:13][c:14]2[CH3:15])[c:18]2[cH:19][cH:20][c:21]([CH2:24][CH2:25][CH2:26][OH:27])[cH:22][cH:23]2)[cH:28][cH:29][c:30]([OH:32])[cH:31]1
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반응물 6

HCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium Ion2회HCID 6344DichloromethaneHCID 28123BorohydrideHCID 22137388N-(2-chloro-4-hydroxy-benzyl)-2,4,6-trimethyl-N-[4-(3-oxo-propyl)-phenyl]-benzenesulfonamide

생성물 1

HCID 22137350
N-(2-chloro-4-hydroxy-benzyl)-N-[4-(3-hydroxy-propyl)-phenyl]-2,4,6-trimethyl-benzenesulfonamide

출처 및 근거

ORD 기록
ord-905bf4aba8dd40af82ba6e19bd64faf2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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