8-Prenylquercetin
Basic information
- CAS
143724-75-8- Standard SMILES
CC(C)=CCc1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc12- InChIKey
ZHTTWVRMGWQEOH-UHFFFAOYSA-N- Molecular formula
- C20H18O7
- Average molar mass
- 370.4 g/mol
- Monoisotopic mass
- 370.10525291
Overview
8-Prenylquercetin has been reported in Ophioglossum petiolatum with data available.
Names & identifiers
- Preferred name
- 8-Prenylquercetin
- IUPAC
- 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-(3-methylbut-2-enyl)chromen-4-one
- English name
- 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-(3-methyl-2-buten-1-yl)-
- Molecular formula
- C20H18O7
- Molecular weight
- 370.35
Names & synonyms
8-prenylquercetin2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-(3-methylbut-2-enyl)chromen-4-oneRefChem:1074775143724-75-8CHEMBL1930598-prenyl-quercetinSCHEMBL2686819DTXSID401123716BDBM50240974FP138622PD1833712-(3,4-Dihydroxy-phenyl)-3,5,7-trihydroxy-8-(3-methyl-but-2-enyl)-chromen-4-one
Show more names
Icariin Impurity 74H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-(3-methyl-2-buten-1-yl)-
2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-8-(3-methylbut-2-en-1-yl)-4H-1-benzopyran-4-one
Database identifiers
- CAS
143724-75-8- PubChem CID
- 9799499
- DTXSID
DTXSID401123716- ChEMBL
CHEMBL193059- Nikkaji
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 636
Physicochemical properties
- Boiling point
- 652.9 · 652.9±55.0 °C(Predicted)
- Density
- 1.519 · 1.519±0.06 g/cm3(Predicted)
- pka
- 6.42 · 6.42±0.40(Predicted)
Chemistry & industry
Applications
Uses8-Prenylquercetin is a natural product derived from Quercetin (Q509500). Quercetin is a flavonoid with anticancer activity. It is a mitochondrial ATPase and phosphodiesterase inhibitor. It Inhibits PI3-kinase activity and slightly inhibits PIP kinase activity. Quercetin has antiproliferative effects on cancer cell lines, reduces cancer cell growth via type II estrogen receptors, and arrests human leukemic T cells in late G1 phase of the cell cycle.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…