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Hydrochloric Acid → HCID 178433829, 화합물

HRID 161713
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HRID 161713 반응식
[C:40](=[O:41])([OH:42])[O-:43].[CH3:23][C:24]1=[N:28][N:27]([c:29]2[cH:30][c:31]3[c:36]([cH:37][cH:38]2)[CH2:35][CH2:34][CH2:33][CH2:32]3)[C:26](=[O:39])[CH2:25]1.[CH3:46][CH2:47][OH:48].[ClH:45].[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+:44]>>[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:25]1[C:24]([CH3:23])=[N:28][N:27]([c:29]2[cH:30][c:31]3[c:36]([cH:37][cH:38]2)[CH2:35][CH2:34][CH2:33][CH2:32]3)[C:26]1=[O:39]
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 510365803-Methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-5(4H)-one

생성물 1

HCID 178433829HCID 178433829, 화합물

출처 및 근거

ORD 기록
ord-19c6784ca57b420eaeb214518a02e460
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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