기본 정보
- CAS
129491-63-0- 표준 SMILES
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C- InChIKey
XEFORNHNQOHGSE-CJRSTVEYSA-N- 분자식
- C28H40N2O6
- 평균 분자량
- 500.6 g/mol
- 단동위원소 질량
- 500.288637
이름 및 식별자
- 우선 이름
- L-Iditol, 1,2,5,6-tetradeoxy-2,5-bis(((1,1-dimethylethoxy)carbonyl)amino)-1,6-diphenyl-
- IUPAC
- tert-butyl N-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,6-diphenylhexan-2-yl]carbamate
이름 및 동의어
129491-63-0CHEMBL9618L-Iditol, 1,2,5,6-tetradeoxy-2,5-bis(((1,1-dimethylethoxy)carbonyl)amino)-1,6-diphenyl-(3R,4R)-N,N'-(t-Butyloxycarbonyl)-2,5-diamino-3,4-dihydroxy-1,6-diphenylhexane1,6-Diphenylhexane deriv.L-Iditol, 1,2,5,6-tetradeoxy-2,5-bis[[(1,1-dimethylethoxy)carbonyl]amino]-1,6-diphenyl-SCHEMBL6446193DTXSID90156186XEFORNHNQOHGSE-CJRSTVEYSA-NBDBM50014151(2S,3R, 4R, 5S)-2,5-di-(N-((t-butyloxy)carbonyl)amino)-3,4-dihydroxy-1,6-diphenylhexane(2S,3R,4R,5S)-2,5-di(N-((t-butyloxy)carbonyl)amino)-3,4-dihydroxy-1,6-diphenylhexane
이름 더 보기
(2S,3R,4R,5S)-2,5-Di-(N-((t-butyloxy)carbonyl)amino)-3,4-dihydroxy-1,6-diphenylhexane2,5-Bis[(tert-butoxycarbonyl)amino]-1,2,5,6-tetradeoxy-1,6-diphenyl-L-iditoldi-tert-butyl ((2S,3R,4R,5S)-3,4-dihydroxy-1,6-diphenylhexane-2,5-diyl)dicarbamate((1S,2R,3R,4S)-1-Benzyl-4-tert-butoxycarbonylamino-2,3-dihydroxy-5-phenyl-pentyl)-carbamic acid tert-butyl ester(2S, 3R, 4R, 5S)-2,5-Di-(N-((t-butyloxy)carbonyl)amino)-3,4-dihydroxy-1,6-diphenylhexanetert-butyl N-[(1S,2R,3R,4S)-1-benzyl-4-(tert-butoxycarbonylamino)-2,3-dihydroxy-5-phenyl-pentyl]carbamate
물성
구조 계산 물성
- XLogP
- 4.4
- 극성 표면적
- 117 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 36
- 형식 전하
- 0
- 복잡도
- 617
관련 반응
5건
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