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Cabreuvin

CAT: 0013-GTR19248533-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19248533-02Size:10 mg
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Description
Cabreuvin is a natural isoflavonoid isolated from Calopogonium mucunoides. It acts as a weak urease inhibitor, making it a compound of interest for biochemical research, particularly in studies of enzyme kinetics and potential antimicrobial applications in vitro.
CAS Number
1621-61-0
Field of Research
Infectious Disease & Virology
Smiles
O=C1C2=CC=C (OC) C=C2OC=C1C=3C=CC (OC) =C (OC) C3
Molecular Formula
C18H16O5
Molecular Weight
312.317
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cabreuvin

Cabreuvin is a methoxyisoflavone.

CAS Number1621-61-0
PubChem CID628528
IUPAC Name3-(3,4-dimethoxyphenyl)-7-methoxychromen-4-one
Molecular FormulaC18H16O5
Molecular Weight312.3
XLogP3.1
Topological Polar Surface Area54
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity460
SMILES
COC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC(=C(C=C3)OC)OC
InChI
InChI=1S/C18H16O5/c1-20-12-5-6-13-16(9-12)23-10-14(18(13)19)11-4-7-15(21-2)17(8-11)22-3/h4-10H,1-3H3
InChIKey
UKWLNMIPRJLYGH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cabreuvin
CAS: 1621-61-0
CID: 628528
Formula: C18H16O5
MW: 312.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight312.3
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass312.09977361
Monoisotopic Mass312.09977361
Topological Polar Surface Area54 Ų
Heavy Atom Count23
Formal Charge0
Complexity460
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-N15412-01Cabreuvin

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