Myricetin

Myricetin
Compound Structure:
Synonyms: 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one; myricetin; Cannabiscetin; Myricetol; Myricitin; 3,5,7-Trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one; 3,3',4',5,5',7-Hexahydroxyflavone; 3,5,7,3',4',5'-Hexahydroxyflavone
Compound ID: NMPC-1276
PubChem ID:

5281672

Molecular Formula: C15H10O8
Canonical SMILES: C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O
InChIKey: IKMDFBPHZNJCSN-UHFFFAOYSA-N
About the compound:

Myricetin is a hexahydroxyflavone that is flavone substituted by hydroxy groups at positions 3, 3', 4', 5, 5' and 7. It has been isolated from the leaves of Myricarubra and other plants. It has a role as a cyclooxygenase 1 inhibitor, an antineoplastic agent, an antioxidant, a plant metabolite, a food component, a hypoglycemic agent and a geroprotector. It is a hexahydroxyflavone and a 7-hydroxyflavonol. It is a conjugate acid of a myricetin(1-).

Properties:

Chemical and Physical Properties

Computed Properties

Property Name

Property Value

Molecular Weight

318.23 g/mol

XLogP3

1.2

Hydrogen Bond Donor Count

6

Hydrogen Bond Acceptor Count

8

Rotatable Bond Count

1

Exact Mass

318.03756727 g/mol

Monoisotopic Mass

318.03756727 g/mol

Topological Polar Surface Area

148Ų

Heavy Atom Count

23

Formal Charge

0

Complexity

506

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Physical Description

Solid

Melting Point

357°C

Solubility 

Sparingly soluble in boiling water; soluble in alcohol. Practically insoluble in chloroform, acetic acid

Source: PubChem                        

Source Species: Bridelia ferruginea.
Bryophyllum pinnatum
Senna alata
Luffa cylindrica
Talinum triangulare
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