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Hydrochloric Acid → Hydrochloric Acid

HRID 2143603
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HRID 2143603 반응식
[C:1](=[O:2])([CH3:3])[NH:4][CH2:5][c:6]1[cH:7][c:8]2[c:12]([cH:13][cH:14]1)[CH2:11][N:10]([c:15]1[c:16]([F:32])[cH:17][c:18]3[c:19](=[O:31])[c:20]([C:28](=[O:29])[OH:30])[cH:21][n:22]([CH:25]4[CH2:26][CH2:27]4)[c:23]3[cH:24]1)[CH2:9]2.[CH3:35][CH2:36][OH:37].[ClH:33].[OH2:34]>>[ClH:33].[NH2:4][CH2:5][c:6]1[cH:7][c:8]2[c:12]([cH:13][cH:14]1)[CH2:11][N:10]([c:15]1[c:16]([F:32])[cH:17][c:18]3[c:19](=[O:31])[c:20]([C:28](=[O:29])[OH:30])[cH:21][n:22]([CH:25]4[CH2:26][CH2:27]4)[c:23]3[cH:24]1)[CH2:9]2
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반응물 4

HCID 313Hydrochloric AcidHCID 702EthanolHCID 962WaterHCID 572941317-(5-Acetamidomethyl-2-isoindolinyl)-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

생성물 2

HCID 313Hydrochloric AcidHCID 147958037-[5-(Aminomethyl)-1,3-dihydroisoindol-2-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid

출처 및 근거

ORD 기록
ord-02f5b26dc444408a81f20be6616a53fc
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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