기본 정보
- CAS
142451-65-8- 표준 SMILES
C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O- InChIKey
BCNBWICEIXAVQF-DLVIKRKZSA-N- 분자식
- C27H30O15
- 평균 분자량
- 594.5 g/mol
- 단동위원소 질량
- 594.15847025
개요
Kaempferol-3-O-glucosyl(1-2)rhamnoside has been reported in Crocus speciosus and Ginkgo biloba with data available.
이름 및 식별자
- 우선 이름
- 3-((6-Deoxy-2-O-beta-D-glucopyranosyl-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
- IUPAC
- 3-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
- 현지명
- 캠페롤-3-O-글루코실(1-2)람노사이드
- 영어명
- kaempferol-3-O-glucosyl(1-2)rhamnoside
- 분자식
- C27H30O15
- 분자량
- 594.52
이름 및 동의어
142451-65-8Kaempferol-3-O-glucosyl(1-2)rhamnosideKemp-glu-rham3-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-oneKempferol-3-O-glucosyl(1-2)rhamnosideDTXSID901620453-((6-Deoxy-2-O-beta-D-glucopyranosyl-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one3-((2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxyoxan-2-yl)oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-oneRefChem:150819DTXCID3084536Kaempferol-3-O-beta-D-glucosyl(1-2)rhamnosideKaempferol 3-O-|A-L-rhamnopyranosyl(2,1)-|A-L-rhamnopyranoside
이름 더 보기
캠페롤-3-O-글루코실(1-2)람노사이드Kaempferol-3-O-β-D-glucosyl(1-2)rhamnosideKaempferol-3-O-β-D-glucosyl(1-2)rhamnosideKaempferol-3-O-β -D-glucosyl(1-2)- α -L-rhamnoside
물성
구조 계산 물성
- XLogP
- -0.4
- 극성 표면적
- 245 Ų
- 수소 결합 공여자 수
- 9
- 수소 결합 수용자 수
- 15
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 42
- 형식 전하
- 0
- 복잡도
- 985
실험 및 물리화학적 성질
LipidsPolyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]
물리화학적 성질
- 끓는 점
- 945.5 · 945.5±65.0 °C(Predicted)
- 밀도
- 1.76 · 1.76±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 6.2 · 6.20±0.40(Predicted)
화학 및 산업
공급사32 곳
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成都彼样生物科技有限公司18108052721 · [email protected]
成都普睿法药物研发有限公司82633860 18982077548 · [email protected]
Aladdin Scientific[email protected]
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上海诗丹德标准技术服务有限公司021-021-57127007-6622-6622 17621252073 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
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