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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Glyoxylic acid, monohydrate → 2-(4-(2-(3-((Tert-butoxycarbonyl(methyl)amino)methyl)-4-(isopropylsulfonyl)phenylcarbamoyloxy)ethyl)-3-ethylphenyl)-2-(5-carbamoyl-2-fluorophenylamino)acetic acid

HRID 735619
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HRID 735619 반응식
[C:1]([O:5][C:6]([N:8]([CH2:10][C:11]1[CH:12]=[C:13]([NH:23][C:24]([O:26][CH2:27][CH2:28][C:29]2[CH:34]=[CH:33][C:32](B(O)O)=[CH:31][C:30]=2[CH2:38][CH3:39])=[O:25])[CH:14]=[CH:15][C:16]=1[S:17]([CH:20]([CH3:22])[CH3:21])(=[O:19])=[O:18])[CH3:9])=[O:7])([CH3:4])([CH3:3])[CH3:2].[NH2:40][C:41]1[CH:42]=[C:43]([CH:47]=[CH:48][C:49]=1[F:50])[C:44]([NH2:46])=[O:45].O.[C:52]([OH:56])(=[O:55])[CH:53]=O>>[C:1]([O:5][C:6]([N:8]([CH2:10][C:11]1[CH:12]=[C:13]([NH:23][C:24]([O:26][CH2:27][CH2:28][C:29]2[CH:34]=[CH:33][C:32]([CH:53]([NH:40][C:41]3[CH:42]=[C:43]([C:44](=[O:45])[NH2:46])[CH:47]=[CH:48][C:49]=3[F:50])[C:52]([OH:56])=[O:55])=[CH:31][C:30]=2[CH2:38][CH3:39])=[O:25])[CH:14]=[CH:15][C:16]=1[S:17]([CH:20]([CH3:22])[CH3:21])(=[O:19])=[O:18])[CH3:9])=[O:7])([CH3:4])([CH3:3])[CH3:2]
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참가 물질

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반응물 3

HCID 15620607Glyoxylic acid, monohydrateHCID 167821003-Amino-4-fluorobenzamideHCID 578426934-(2-(3-((Tert-butoxycarbonyl(methyl)amino)methyl)-4-(isopropylsulfonyl)phenylcarbamoyloxy)ethyl)-3-ethylphenylboronic acid

생성물 1

HCID 578427252-(4-(2-(3-((Tert-butoxycarbonyl(methyl)amino)methyl)-4-(isopropylsulfonyl)phenylcarbamoyloxy)ethyl)-3-ethylphenyl)-2-(5-carbamoyl-2-fluorophenylamino)acetic acid수율 62%

실험 절차

Using a procedure analogous to that used to prepare 2D, 43B (362 mg, 0.65 mmol) was reacted with 3-amino-4-fluorobenzamide and glyoxylic acid monohydrate to afford 43C (296 mg, 62%) as a yellow oil. MS (ESI) m/z 729.3 (M+H)+.

출처 및 근거

ORD 기록
ord-8db93195244a4f1e80b34d6f50576ea6
출처 데이터셋
uspto-grants-2009_09
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07592331B2

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