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Hydrochloric Acid → HCID 178433805, 화합물

HRID 699092
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HRID 699092 반응식
[C:39](=[O:40])([OH:41])[O-:42].[CH2:23]1[CH2:24][CH2:25][c:26]2[cH:27][c:28]([N:32]3[N:33]=[C:34]([CH3:38])[CH2:35][C:36]3=[O:37])[cH:29][cH:30][c:31]21.[CH3:45][CH2:46][OH:47].[ClH:44].[N:19]([O-:20])=[O:21].[NH2:1][c:2]1[c:3]([OH:18])[c:4](-[c:9]2[cH:10][c:11]([C:15](=[O:16])[OH:17])[cH:12][cH:13][cH:14]2)[cH:5][c:6]([F:8])[cH:7]1.[Na+:22].[Na+:43]>>[NH:1]([c:2]1[c:3]([OH:18])[c:4](-[c:9]2[cH:10][c:11]([C:15](=[O:16])[OH:17])[cH:12][cH:13][cH:14]2)[cH:5][c:6]([F:8])[cH:7]1)[N:19]=[C:35]1[C:34]([CH3:38])=[N:33][N:32]([c:28]2[cH:27][c:26]3[c:31]([cH:30][cH:29]2)[CH2:23][CH2:24][CH2:25]3)[C:36]1=[O:37]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium Ion2회HCID 946NitriteHCID 210723153'-Amino-5'-fluoro-2'-hydroxy-biphenyl-3-carboxylic acidHCID 574837802-Indan-5-yl-5-methyl-2,4-dihydro-pyrazol-3-one

생성물

1
HCID 178433805HCID 178433805, 화합물

출처 및 근거

ORD 기록
ord-8083f8d55632415e8c48ea4cd76eb4f8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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