Licoflavone A

CAT: 0127-BUP00561-04Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP00561-04Size:25 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

61153-77-3

Purity

=98%

Smiles

CC(C)=CCc1cc2c(cc1O)oc(cc2=O)-c1ccc(O)cc1

Chemical Information

Licoflavone A

Licoflavone A is a member of flavones.

CAS Number	61153-77-3
PubChem CID	5319000
IUPAC Name	7-hydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)chromen-4-one
Molecular Formula	C20H18O4
Molecular Weight	322.4
XLogP	5.2
Topological Polar Surface Area	66.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	24
Formal Charge	0
Complexity	524

SMILES

CC(=CCC1=CC2=C(C=C1O)OC(=CC2=O)C3=CC=C(C=C3)O)C

InChI

InChI=1S/C20H18O4/c1-12(2)3-4-14-9-16-18(23)11-19(24-20(16)10-17(14)22)13-5-7-15(21)8-6-13/h3,5-11,21-22H,4H2,1-2H3

InChIKey

HJGURBGBPIKRER-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 61153-77-3

CID: 5319000

Formula: C20H18O4

MW: 322.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	322.4
XLogP3	5.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	322.12050905
Monoisotopic Mass	322.12050905
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	524
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

Catalog	Name
BUP20806-01	Licoflavonol