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Hydrochloric Acid → Hydrochloric Acid

HRID 812735
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HRID 812735 반응식
[B:35]([F:36])[F:37].[CH3:1][O-:2].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:45][S:46](=[O:47])[CH3:48].[CH:14]1([n:17]2[cH:18][c:19]([C:32](=[O:33])[OH:34])[c:20](=[O:31])[c:21]3[cH:22][c:23]([F:30])[c:24]([F:29])[c:25]([O:27][CH3:28])[c:26]23)[CH2:15][CH2:16]1.[ClH:4].[ClH:5].[NH2:6][CH:7]1[CH2:8][NH:9][CH2:10][CH:11]1[O:12][CH3:13].[Na+:3].[OH2:49]>>[ClH:4].[NH2:6][CH:7]1[CH2:8][N:9]([c:24]2[c:23]([F:30])[cH:22][c:21]3[c:20](=[O:31])[c:19]([C:32](=[O:33])[OH:34])[cH:18][n:17]([CH:14]4[CH2:15][CH2:16]4)[c:26]3[c:25]2[O:27][CH3:28])[CH2:10][CH:11]1[O:12][CH3:13]
참가 물질출처 및 근거반응 노트

참가 물질

11

반응물 9

HCID 313Hydrochloric Acid2회HCID 679Dimethyl SulfoxideHCID 923Sodium IonHCID 962WaterHCID 8471TriethylamineHCID 139565DifluoroboraneHCID 3826051Methoxide
HCID 7019465
1-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-methoxy-4-oxo-3-quinolinecarboxylic acid
HCID 14457269cis-4-Methoxypyrrolidin-3-amine

생성물 2

HCID 313Hydrochloric AcidHCID 144572897-(3-Amino-4-methoxypyrrolidin-1-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid

출처 및 근거

ORD 기록
ord-e54d41165bba4604b97854000f3989c3
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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