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Kolaflavanone

CAT: 0013-GTR19223426-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19223426-01Size:100 mg
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Description
Kolaflavanone is a purified compound obtained via methanolic extraction and subsequent defatting. This natural product is utilized in biochemical research for in vitro studies, particularly in investigations of antioxidant and anti-inflammatory pathways.
CAS Number
68705-66-8
Smiles
O=C1[C@@H] ([C@H] (OC=2C1=C (O) C=C (O) C2) C3=CC=C (O) C=C3) C4=C5C (C (=O) [C@H] (O) [C@H] (O5) C6=CC (O) =C (OC) C=C6) =C (O) C=C4O
Molecular Formula
C31H24O12
Molecular Weight
588.52
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Kolaflavanone

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 member of 4'-methoxyflavanones, a secondary alpha-hydroxy ketone, a ring assembly, a member of dihydroflavonols and a biflavonoid.

CAS Number68705-66-8
PubChem CID155169
IUPAC Name(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
Molecular FormulaC31H24O12
Molecular Weight588.5
XLogP4
Topological Polar Surface Area203
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count12
Rotatable Bond Count4
Heavy Atom Count43
Formal Charge0
Complexity1020
SMILES
COC1=C(C=C(C=C1)[C@@H]2[C@H](C(=O)C3=C(C=C(C(=C3O2)[C@@H]4[C@H](OC5=CC(=CC(=C5C4=O)O)O)C6=CC=C(C=C6)O)O)O)O)O
InChI
InChI=1S/C31H24O12/c1-41-20-7-4-13(8-16(20)34)30-28(40)27(39)24-19(37)11-18(36)23(31(24)43-30)25-26(38)22-17(35)9-15(33)10-21(22)42-29(25)12-2-5-14(32)6-3-12/h2-11,25,28-30,32-37,40H,1H3/t25-,28-,29+,30+/m0/s1
InChIKey
GJWXCPDVDRIBKP-CNTBMXMRSA-N
Chemical Structure
2D Structure
2D structure of Kolaflavanone
CAS: 68705-66-8
CID: 155169
Formula: C31H24O12
MW: 588.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight588.5
XLogP34
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count12
Rotatable Bond Count4
Exact Mass588.12677620
Monoisotopic Mass588.12677620
Topological Polar Surface Area203 Ų
Heavy Atom Count43
Formal Charge0
Complexity1020
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T32410-01Kolaflavanone

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