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3(S)-(2-((2(S)-Benzoylamino-3-methylbutyryl)benzylamino)acetylamino)-4-(4-(2,6-dichlorophenyl)-oxazol-2-yl)-4-oxobutyric Acid → 3(S)-(2-((2(S)-Benzoylamino-3-methylbutyryl)indan-2-ylamino)acetylamino)-4-(4,6-dichlorobenzoxazol-2-yl)-4-oxobutyric Acid

HRID 1456663
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HRID 1456663 반응식
[C:1]([NH:9][C@@H:10]([CH:45]([CH3:47])[CH3:46])[C:11]([N:13]([CH2:38][C:39]1C=[CH:43][CH:42]=[CH:41][CH:40]=1)[CH2:14][C:15]([NH:17][C@H](C(C1OC=C(C2C(Cl)=CC=CC=2Cl)N=1)=O)CC(O)=O)=[O:16])=[O:12])(=[O:8])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[C:48](N[C@@H](C(C)C)C(N(CC(O)=O)CC1C=CC=CC=1)=O)(=O)[C:49]1C=CC=C[CH:50]=1.C(OC(=O)C(N)[C@H](C(OCC=C)=O)C(C1OC=C(C2C(Cl)=CC=CC=2Cl)N=1)O)(C)(C)C.C([O:110][C:111](=[O:134])[CH:112](N)[C@H:113](C(OCC=C)=O)[CH:114]([C:116]1[O:117][C:118]2[CH:124]=[C:123]([Cl:125])[CH:122]=[C:121]([Cl:126])[C:119]=2[N:120]=1)[OH:115])(C)(C)C.C(OC(=O)C[C@H](NC(=O)CN(C(=O)[C@@H](NC(=O)C1C=CC=CC=1)C(C)C)CC1C=CC=CC=1)C(C1OC=C(C2C(Cl)=CC=CC=2Cl)N=1)O)(C)(C)C>>[C:1]([NH:9][C@@H:10]([CH:45]([CH3:46])[CH3:47])[C:11]([N:13]([CH:38]1[CH2:50][C:49]2[C:40](=[CH:41][CH:42]=[CH:43][CH:48]=2)[CH2:39]1)[CH2:14][C:15]([NH:17][C@H:113]([C:114]([C:116]1[O:117][C:118]2[CH:124]=[C:123]([Cl:125])[CH:122]=[C:121]([Cl:126])[C:119]=2[N:120]=1)=[O:115])[CH2:112][C:111]([OH:110])=[O:134])=[O:16])=[O:12])(=[O:8])[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1
참가 물질실험 절차출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 536861393(S)-(2-((2(S)-Benzoylamino-3-methylbutyryl)benzylamino)acetylamino)-4-(4-(2,6-dichlorophenyl)-oxazol-2-yl)-4-oxobutyric AcidHCID 53859725((2(S)-Benzoylamino-3-methylbutyryl)benzylamino)acetic AcidHCID 544408483(S)-(2-((2(S)-Benzoylamino-3-methylbutyryl)benzylamino)acetylamino)-4-(4-(2,6-dichlorophenyl)-oxazol-2-yl)-4-hydroxybutyric Acid tert-Butyl EsterHCID 697241953(S)-(Allyloxycarbonyl)-amino-4-((2,6-dichloro-phenyl)oxazol-2-yl)-4-hydroxy-butyric Acid tert-Butyl Ester
HCID 1317209653(S)-(Allyloxycarbonyl)-amino-4-(4,6-dichorobenzoxazol-2-yl)-4-hydroxy-butyric Acid tert-Butyl Ester

생성물 1

HCID 542387793(S)-(2-((2(S)-Benzoylamino-3-methylbutyryl)indan-2-ylamino)acetylamino)-4-(4,6-dichlorobenzoxazol-2-yl)-4-oxobutyric Acid

실험 절차

Compound 725 was prepared by a method similar to the method used to prepare compound 710, except compound 704 was replaced with compound 724 and compound 707 was replaced with compound 718 in the preparation of compound 708: 1H NMR (500 MHz, CD3OD) δ 8.7-8.6 (m), 8.6-8.4 (m), 8.1 (d), 8.0-7.8 (m), 7.6-7.5 (m), 7.5-7.4 (m), 7.2-7.0 (m), 7.0-6.9 (m), 5.5-5.3 (m), 5.3-5.2 (m), 4.6-4.5 (m), 4.5-4.3 (m), 4.2-4.0 (m), 3.8-3.6 (m), 3.3 (s), 3.2-3.1 (m), 3.1-3.0 (m), 3.0-2.8 (m), 2.7-2.6 (m), 2.4-2.0 (m), 1.2-0.6 (m). ##STR104##

출처 및 근거

ORD 기록
ord-5499f5eb6d314193a537298e38574ba3
출처 데이터셋
uspto-grants-1998_12
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US05843904

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