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Hydrochloric Acid → N-(3-{6-methyl-3-[3-(3-methyl-2-thienyl)propanoyl]-3-azabicyclo[3.1.0]hex-6-yl}phenyl)methanesulfonamide

HRID 198689
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인쇄 미리보기

반응식

HRID 198689 반응식
[C:42](=[O:43])([O-:44])[OH:45].[CH3:1][c:2]1[c:3]([CH2:7][CH2:8][C:9](=[O:10])[OH:11])[s:4][cH:5][cH:6]1.[CH3:24][C:25]1([c:31]2[cH:32][c:33]([NH:37][S:38](=[O:39])(=[O:40])[CH3:41])[cH:34][cH:35][cH:36]2)[CH:26]2[CH2:27][NH:28][CH2:29][CH:30]12.[ClH:23].[Na+:46].[OH2:12].[OH:13][n:14]1[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]2[n:21][n:22]1>>[CH3:1][c:2]1[c:3]([CH2:7][CH2:8][C:9](=[O:11])[N:28]2[CH2:27][CH:26]3[C:25]([CH3:24])([c:31]4[cH:32][c:33]([NH:37][S:38](=[O:39])(=[O:40])[CH3:41])[cH:34][cH:35][cH:36]4)[CH:30]3[CH2:29]2)[s:4][cH:5][cH:6]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 757711-HydroxybenzotriazoleHCID 164951143-(3-Methylthiophen-2-yl)propanoic acidHCID 22141143N-[3-(6-methyl-3-azabicyclo[3.1.0]hex-6-yl)phenyl)methanesulfonamide

생성물

1
HCID 22141226N-(3-{6-methyl-3-[3-(3-methyl-2-thienyl)propanoyl]-3-azabicyclo[3.1.0]hex-6-yl}phenyl)methanesulfonamide

출처 및 근거

ORD 기록
ord-c34ce9f2f13e41748e104a092cb11067
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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