기본 정보
- CAS
52187-80-1- 표준 SMILES
O=c1cc(-c2ccc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12- InChIKey
BISZYPSIZGKOFA-IPOZFMEPSA-N- 분자식
- C27H30O16
- 평균 분자량
- 610.5 g/mol
- 단동위원소 질량
- 610.15338487
개요
Luteolin-3',7-di-O-glucoside is a glycoside and a member of flavonoids.
이름 및 식별자
- 우선 이름
- Luteolin 3',7-diglucoside
- IUPAC
- 5-hydroxy-2-[4-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
- 현지명
- 루테오린-3',7-DI-O-글루코사이드
- 영어명
- LUTEOLIN-3',7-DI-O-GLUCOSIDE
- 분자식
- C27H30O16
- 분자량
- 610.52
이름 및 동의어
52187-80-1Luteolin-7,3'-di-O-gflucosideLuteolin 3',7-diglucosideDTXSID902002145-hydroxy-2-[4-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one5-hydroxy-2-(4-hydroxy-3-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxyphenyl)-7-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxychromen-4-oneRefChem:800151DTXCID90122705257-724-7Luteolin-3',7-di-O-glucosideluteolin-3',7-diglucoside5-hydroxy-2-(4-hydroxy-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
이름 더 보기
루테오린-3',7-DI-O-글루코사이드LUTEOLIN-7,3'-DI-O-GLUCOSIDELUTEOLIN-7,3'-DIGLUCOSIDELuteolin 3′,7-O- diglucosideLUTEOLIN-3'',7-DIGLUCOSIDE hplcLUTEOLIN-7,3''-DIGLUCOSIDE WITH HPLCLUTEOLIN-7,3''-DI-O-GLUCOSIDE WITH HPLC2-(3-β-D-Glucopyranosyloxy-4-hydroxyphenyl)-7-(β-D-glucopyranosyloxy)-5-hydroxy-4H-1-benzopyran-4-one
Luteolin-3 inverted exclamation marka,7-diglucosideLuteolin 7,3'-diglucosideEINECS 257-724-7Luteolin-37-diglucosideluteoloside-3-O-glucosideLuteolin 3?,7-diglucosideorb1684439CHEMBL1744031
데이터베이스 식별자
- CAS
52187-80-1- PubChem CID
- 5490298
- DTXSID
DTXSID90200214- ChEMBL
CHEMBL1744031- ChEBI
CHEBI:167535- EC Number
- 257-724-7
- Nikkaji
- J279.475F
물성
구조 계산 물성
- XLogP
- -1.3
- 극성 표면적
- 266 Ų
- 수소 결합 공여자 수
- 10
- 수소 결합 수용자 수
- 16
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 43
- 형식 전하
- 0
- 복잡도
- 996
실험 및 물리화학적 성질
LipidsPolyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]
물리화학적 성질
- 녹는점
- 220 · 220-250°C
- 끓는 점
- 998 · 998.0±65.0 °C(Predicted)
- 밀도
- 1.742 · 1.742±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 6.09 · 6.09±0.40(Predicted)
- LogP
- -3.49 · -3.490 (est)
안전 및 규제
GHS 분류
GHS ClassificationNot Classified
유해성 정보
Hazard Classes and CategoriesNot Classified
화학 및 산업
공급사30 곳
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