(alphaR)-alpha-((6-O-alpha-L-Arabinopyranosyl-beta-D-glucopyranosyl)oxy)benzeneacetonitrile
기본 정보
- CAS
155-57-7- 표준 SMILES
N#C[C@H](O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1- InChIKey
YYYCJNDALLBNEG-GNRUMFBNSA-N- 분자식
- C19H25NO10
- 평균 분자량
- 427.4 g/mol
- 단동위원소 질량
- 427.14784599
개요
Vicianin is a cyanogenic glycoside.
이름 및 식별자
- 우선 이름
- (alphaR)-alpha-((6-O-alpha-L-Arabinopyranosyl-beta-D-glucopyranosyl)oxy)benzeneacetonitrile
- IUPAC
- (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile
이름 및 동의어
Vicianin155-57-7CQU61CXY3D(2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile6-o-alpha-l-arabinopyranosyl-beta-d-glucopyranosideDTXSID70935113(2R)-2-phenyl-2-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(((2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl)oxymethyl)oxan-2-yl)oxyacetonitrile(2R)-2-phenyl-2-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(((2S,3R,4S,5S)-3,4,5-trihydroxytetrahydropyran-2-yl)oxymethyl)tetrahydropyran-2-yl)oxy-acetonitrile(2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxytetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-acetonitrileRefChem:906331mandelonitrile beta-vicianosideDTXCID401514719
이름 더 보기
(alphaR)-alpha-((6-O-alpha-L-Arabinopyranosyl-beta-D-glucopyranosyl)oxy)benzeneacetonitrileBenzeneacetonitrile, alpha-((6-O-alpha-L-arabinopyranosyl-beta-D-glucopyranosyl)oxy)-, (R)-R-VICIANINC01870AC1LCV2VVICIANIN [MI]SCHEMBL17387703CHEBI:166510
물성
구조 계산 물성
- XLogP
- -2.6
- 극성 표면적
- 182 Ų
- 수소 결합 공여자 수
- 6
- 수소 결합 수용자 수
- 11
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 593
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