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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Dimethyl Sulfoxide → rac-(2'S,3'R,4'S,5'R)-6-chloro-4'-(3-chloro-2-fluoro-phenyl)-2'-(2,2-dimethyl-propyl)-2-oxo-1,2-dihydro-spiro[indole-3,3'-pyrrolidine]-5'-carboxylic acid (2-carbamoyl-pyrimidin-5-yl)-amide

HRID 822464
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HRID 822464 반응식
[C:1](#[N:2])[c:3]1[n:4][cH:5][c:6]([NH:9][C:10](=[O:11])[CH:12]2[CH:13]([c:32]3[c:33]([F:39])[c:34]([Cl:38])[cH:35][cH:36][cH:37]3)[C:14]3([C:15](=[O:24])[NH:16][c:17]4[cH:18][c:19]([Cl:23])[cH:20][cH:21][c:22]43)[CH:25]([CH2:27][C:28]([CH3:29])([CH3:30])[CH3:31])[NH:26]2)[cH:7][n:8]1.[CH3:44][S:45]([CH3:46])=[O:47].[Na+:43].[OH-:42].[OH:40][OH:41]>>[C:1]([NH2:2])([c:3]1[n:4][cH:5][c:6]([NH:9][C:10](=[O:11])[CH:12]2[CH:13]([c:32]3[c:33]([F:39])[c:34]([Cl:38])[cH:35][cH:36][cH:37]3)[C:14]3([C:15](=[O:24])[NH:16][c:17]4[cH:18][c:19]([Cl:23])[cH:20][cH:21][c:22]43)[CH:25]([CH2:27][C:28]([CH3:29])([CH3:30])[CH3:31])[NH:26]2)[cH:7][n:8]1)=[O:40]
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6

반응물 5

HCID 679Dimethyl SulfoxideHCID 784Hydrogen PeroxideHCID 923Sodium IonHCID 961HydroxideHCID 76741129rac-(2'S,3'R,4'S,5'R)-6-chloro-4'-(3-chloro-2-fluoro-phenyl)-2'-(2,2-dimethyl-propyl)-2-oxo-1,2-dihydro-spiro[indole-3,3'-pyrrolidine]-5'-carboxylic acid (2-cyano-pyrimidin-5-yl)-amide

생성물 1

HCID 76741081
rac-(2'S,3'R,4'S,5'R)-6-chloro-4'-(3-chloro-2-fluoro-phenyl)-2'-(2,2-dimethyl-propyl)-2-oxo-1,2-dihydro-spiro[indole-3,3'-pyrrolidine]-5'-carboxylic acid (2-carbamoyl-pyrimidin-5-yl)-amide

출처 및 근거

ORD 기록
ord-1594575e06a44c77a4ba211e629a4f91
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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