기본 정보
- CAS
126105-11-1- 표준 SMILES
CC(CCC(OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)C(C)(C)O)C1CCC2(C)C3CC=C4C(CCC(OC5OC(COC6OC(CO)C(O)C(O)C6O)C(O)C(O)C5O)C4(C)C)C3(C)C(=O)CC12C- InChIKey
CGGWHBLPUUKEJC-UHFFFAOYSA-N- 분자식
- C60H100O29
- 평균 분자량
- 1,285.4 g/mol
- 단동위원소 질량
- 1,284.63502715
개요
11-oxo-Mogroside V has been reported in Siraitia siamensis with data available.
이름 및 식별자
- 우선 이름
- 11-oxo-mogroside V
- IUPAC
- 17-[5-[4,5-dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-6-hydroxy-6-methylheptan-2-yl]-4,4,9,13,14-pentamethyl-3-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-11-one
- 영어명
- (24R)-3β-[6-O-(β-D-Glucopyranosyl)-β-D-glucopyranosyloxy]-24-[2-O,6-O-bis(β-D-glucopyranosyl)-β-D-glucopyranosyloxy]25-hydroxycucurbita-5-ene-11-one
- 분자식
- C60H100O29
- 분자량
- 1285.42
이름 및 동의어
11-oxo-Mogroside VRefChem:90801317-(5-(4,5-dihydroxy-3-(3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy-6-((3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxymethyl)oxan-2-yl)oxy-6-hydroxy-6-methylheptan-2-yl)-4,4,9,13,14-pentamethyl-3-(3,4,5-trihydroxy-6-((3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxymethyl)oxan-2-yl)oxy-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta(a)phenanthren-11-one126105-11-111-Oxomogroside V [M+H]+SCHEMBL21980463PD11781411-Oxomogroside V11-O-Mogroside V11-O momorin VMogroside V, 11-oxo-11-Oxomogroside V-RM
이름 더 보기
11-oxo-mogroside V (Standard)(24R)-3β-[6-O-(β-D-Glucopyranosyl)-β-D-glucopyranosyloxy]-24-[2-O,6-O-bis(β-D-glucopyranosyl)-β-D-glucopyranosyloxy]-25-hydroxycucurbit-5-en-11-one(24R)-3β-[6-O-(β-D-Glucopyranosyl)-β-D-glucopyranosyloxy]-24-[2-O,6-O-bis(β-D-glucopyranosyl)-β-D-glucopyranosyloxy]25-hydroxycucurbita-5-ene-11-one
물성
구조 계산 물성
- XLogP
- -4
- 극성 표면적
- 474 Ų
- 수소 결합 공여자 수
- 18
- 수소 결합 수용자 수
- 29
- 회전 가능 결합 수
- 20
- 무거운 원자 수
- 89
- 형식 전하
- 0
- 복잡도
- 2,410
물리화학적 성질
- 밀도
- 1.51 · 1.51
- 저장 조건
- 2 · 2-8°C
- 용해도
- Soluble in methanol and water
- 물리적 상태
- 가루
- 산도 계수 (pKa)
- 12.82 · 12.82±0.70(Predicted)
- 색상
- 하얀색
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- WGK 3
- HS 번호
- 29329990
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
공급사100 곳
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