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Hydrochloric Acid → HCID 178486445, 화합물

HRID 817553
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HRID 817553 반응식
[C:52](=[O:53])([OH:54])[O-:55].[CH3:32][O:33][c:34]1[cH:35][c:36]2[c:40]([cH:41][c:42]1[NH2:43])[N:39]([C:44]([CH:45]1[N:46]([CH3:50])[CH2:47][CH2:48][CH2:49]1)=[O:51])[CH2:38][CH2:37]2.[CH3:57][CH2:58][O:59][CH2:60][CH3:61].[Cl:2][c:3]1[n:4][c:5]2[c:6]([c:7]3[n:8][c:9]4[cH:10][cH:11][cH:12][c:13]([F:18])[c:14]4[c:15](=[O:17])[n:16]13)[cH:19][cH:20][n:21]2[S:22](=[O:23])(=[O:24])[c:25]1[cH:26][cH:27][c:28]([CH3:31])[cH:29][cH:30]1.[ClH:1].[Na+:56].[OH:62][CH2:63][C:64]([F:65])([F:66])[F:67]>>[c:3]1([NH:43][c:42]2[c:34]([O:33][CH3:32])[cH:35][c:36]3[c:40]([cH:41]2)[N:39]([C:44]([CH:45]2[N:46]([CH3:50])[CH2:47][CH2:48][CH2:49]2)=[O:51])[CH2:38][CH2:37]3)[n:4][c:5]2[c:6]([c:7]3[n:8][c:9]4[cH:10][cH:11][cH:12][c:13]([F:18])[c:14]4[c:15](=[O:17])[n:16]13)[cH:19][cH:20][n:21]2[S:22](=[O:23])(=[O:24])[c:25]1[cH:26][cH:27][c:28]([CH3:31])[cH:29][cH:30]1
참가 물질출처 및 근거반응 노트

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8

반응물 7

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium IonHCID 3283Diethyl EtherHCID 64092,2,2-TrifluoroethanolHCID 594416275-chloro-8-fluoro-3-[(4-methylphenyl)sulfonyl]pyrrolo[2',3':4,5]pyrimido[6,1-b]quinazolin-7(3H)-one
HCID 59441782
(6-Amino-5-methoxy-2,3-dihydroindol-1-yl)-(1-methylpyrrolidin-2-yl)methanone

생성물 1

HCID 178486445HCID 178486445, 화합물

출처 및 근거

ORD 기록
ord-fce3b0549ab94befa8f8055ed4967ccf
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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