kolaflavanone (kolaviron)

Compound Structure:

Synonyms:

(2R,3R)-8-[(2S,3R)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-3,5,7-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one; Kolaflavanone; Kolaviron

Compound ID:

NMPC-1184

PubChem ID:

155169

Molecular Formula:

C31H24O12

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(C(=O)C3=C(C=C(C(=C3O2)C4C(OC5=CC(=CC(=C5C4=O)O)O)C6=CC=C(C=C6)O)O)O)O)O

InChIKey:

GJWXCPDVDRIBKP-CNTBMXMRSA-N

About the compound:

Kolaflavanone is a biflavonoid isolated from the seeds of Garcinia kola that has been shown to exhibit hepatoprotective activity. It has a role as a hepatoprotective agent and a plant metabolite. It is a biflavonoid, a ring assembly, a member of dihydroflavonols, a secondary alpha-hydroxy ketone and a member of 4'-methoxyflavanones.

Properties:

Chemical and Physical Properties

Property Name	Property Value
Molecular Weight	588.5 g/mol
XLogP3-AA	4
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	4
Exact Mass	588.12677620 g/mol
Monoisotopic Mass	588.12677620 g/mol
Topological Polar Surface Area	203Å²
Heavy Atom Count	43
Formal Charge	0
Complexity	1020
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source: PubChem

Source Species:

Garcinia kola
Erythrina sigmoidea.

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