(2S,4R)-N-[(1S)-2-hydroxy-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide
기본 정보
- CAS
12768-69-3- 표준 SMILES
CCC[C@@H]1C[C@@H](C(=O)N[C@@H](C(C)O)C2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)N(C)C1- InChIKey
OJMMVQQUTAEWLP-ZUWRKQLMSA-N- 분자식
- C18H34N2O6S
- 평균 분자량
- 406.5 g/mol
- 단동위원소 질량
- 406.21375798
이름 및 식별자
- 우선 이름
- (2S,4R)-N-[(1S)-2-hydroxy-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide
- IUPAC
- (2S,4R)-N-[(1S)-2-hydroxy-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide
이름 및 동의어
(2S,4R)-N-[(1S)-2-hydroxy-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide12768-69-3DTXSID50925936OJMMVQQUTAEWLP-ZUWRKQLMSA-NMethyl 6,8-dideoxy-6-({hydroxy[(2S,4R)-1-methyl-4-propylpyrrolidin-2-yl]methylidene}amino)-1-thio-beta-L-altro-octopyranosideMethyl 6,8-dideoxy-6-{[hydroxy(1-methyl-4-propylpyrrolidin-2-yl)methylidene]amino}-1-thiooctopyranoside
데이터베이스 식별자
- CAS
12768-69-3- PubChem CID
- 9063
- DTXSID
DTXSID50925936
물성
구조 계산 물성
- XLogP
- 0.2
- 극성 표면적
- 148 Ų
- 수소 결합 공여자 수
- 5
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 498
관련 반응
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