Chloroform → Methanesulfonic Acid

HRID 663272

반응식

HRID 663272 반응식
[CH3:30][S:31]([OH:32])(=[O:33])=[O:34].[CH:1]1([n:4]2[cH:5][c:6]([C:27](=[O:28])[OH:29])[c:7](=[O:26])[c:8]3[cH:9][c:10]([F:25])[c:11]([N:15]4[CH2:16][CH:17]([n:20]5[n:21][cH:22][n:23][cH:24]5)[CH2:18][CH2:19]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1.[CH:35]([Cl:36])([Cl:37])[Cl:38]>>[CH3:30][S:31](=[O:32])(=[O:33])[OH:34].[CH:1]1([n:4]2[cH:5][c:6]([C:27](=[O:28])[OH:29])[c:7](=[O:26])[c:8]3[cH:9][c:10]([F:25])[c:11]([N:15]4[CH2:16][CH:17]([n:20]5[n:21][cH:22][n:23][cH:24]5)[CH2:18][CH2:19]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1

참가 물질

5

반응물 3

HCID 6212ChloroformHCID 6395Methanesulfonic AcidHCID 190059571-Cyclopropyl-6,8-difluoro-7-[3-(1,2,4-triazol-1-yl) pyrrolidin-1-yl]-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

생성물 2

HCID 6395Methanesulfonic AcidHCID 190059571-Cyclopropyl-6,8-difluoro-7-[3-(1,2,4-triazol-1-yl) pyrrolidin-1-yl]-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

출처 및 근거

ORD 기록
ord-205d1cdf791e4c98be22acb5751fe1b0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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