Xanthomicrol
Grundinformationen
- CAS
16545-23-6- Standard-SMILES
COc1c(OC)c(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1OC- InChIKey
SAMBWAJRKKEEOR-UHFFFAOYSA-N- Summenformel
- C18H16O7
- Durchschnittliche Molmasse
- 344,3 g/mol
- Monoisotopische Masse
- 344,08960285
Überblick
Xanthomicrol is a trimethoxyflavone that is flavone substituted by methoxy groups at positions 6, 7 and 8 and hydroxy groups at positions 5 and 4'. It has a role as an antineoplastic agent and a plant metabolite. It is a trimethoxyflavone and a dihydroxyflavone. It is functionally related to a flavone.
Namen und Bezeichner
- Bevorzugter Name
- Xanthomicrol
- IUPAC
- 5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxychromen-4-one
- Englischer Name
- 5,4''-DIHYDROXY-6,7,8-TRIMETHOXYFLAVONE
- Summenformel
- C18H16O7
- Molmasse
- 344.32
Namen und Synonyme
Xanthomicrol16545-23-64',5-dihydroxy-6,7,8-trimethoxyflavone5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxychromen-4-one5-Hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-4H-1-benzopyran-4-one5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-4H-chromen-4-one3IN82Y8CAA4H-1-Benzopyran-4-one, 5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-NSC-79323CHEBI:35047DTXSID20167947RefChem:195145
Weitere Namen anzeigen
5,4''-DIHYDROXY-6,7,8-TRIMETHOXYFLAVONE
DTXCID30904384H-1-Benzopyran-4-one,5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-5,4'-DIHYDROXY-6,7,8-TRIMETHOXYFLAVONECHEMBL4761215-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-chromen-4-oneUNII-3IN82Y8CAANSC 793238-Methoxycirsimaritin
Datenbank-Bezeichner
- CAS
16545-23-6- PubChem CID
- 73207
- DTXSID
DTXSID20167947- ChEMBL
CHEMBL476121- ChEBI
CHEBI:35047- UNII
- 3IN82Y8CAA
- Nikkaji
- J14.449E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,9
- Polarare Oberfläche (TPSA)
- 94,5 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 7
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 25
- Formalladung
- 0
- Komplexität
- 512
Experimentelle und physikochemische Eigenschaften
LipidsPolyketides [PK] -> Flavonoids [PK12] -> Flavones and Flavonols [PK1211]
Melting Point227 - 230 °C
Physical DescriptionSolid
Physikochemische Eigenschaften
- Schmelzpunkt
- 225 °C · 225 °C
- Siedepunkt
- 609.9 · 609.9±55.0 °C(Predicted)
- Dichte
- 1.387 · 1.387±0.06 g/cm3(Predicted)
- pka
- 6.85 · 6.85±0.40(Predicted)
- Aggregatzustand
- Solid
- Farbe
- Light yellow to yellow
Chemie und Industrie
Pharmakologische Informationen
Cellular LocationsMembrane
Anwendungen
VerwendenXanthomicrol inhibits growth of human prostate cancer LNCaP cells by epigenetically restoring p21 gene expression and inhibiting cancer stem-like cell proliferation.
Vor- und nachgelagerte Produkte
Nachgelagerte Produkte
Anbieter15 Anbieter
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
常州平博医药研发有限公司086-0519-83990708 18915800124 · [email protected]
BOC Sciences[email protected]
Changzhou PBpharmaceutical R&D Co.,Ltd0519-83990708 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
四川百奥克睿生物科技有限公司28-86-28-8543-3893 13260669172 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
上海宾穗生物科技有限公司18301908279 · [email protected]
Ergänzende Hinweise
DefinitionChEBI: A trimethoxyflavone that is flavone substituted by methoxy groups at positions 6, 7 and 8 and hydroxy groups at positions 5 and 4'.
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