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Gancaonin G

CAT: 0804-HY-N3920Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N3920Size:1 mg
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Description
Gancaonin G is a 6-prenylated isoflavanone that can be isolated from Glycyrrhiza uralensis. Gancaonin G has antibacterial activity against Streptococcus mutants and MRSA strains[1].
CAS Number
126716-34-5
UNSPSC
12352005
Target
Bacterial
Type
Natural Products
Related Pathways
Anti-infection
Applications
COVID-19-immunoregulation
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/gancaonin-g.html
Purity
99.42
Solubility
10 mM in DMSO
Smiles
O=C1C(C2=CC=C(O)C=C2)=COC3=CC(OC)=C(C/C=C(C)\C)C(O)=C13
Molecular Formula
C21H20O5
Molecular Weight
352.38
References & Citations
[1]He J, et al. Antibacterial compounds from Glycyrrhiza uralensis. J Nat Prod. 2006 Jan;69 (1) :121-4.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Gancaonin G

Gancaonin G is a member of isoflavanones.

CAS Number126716-34-5
PubChem CID480780
IUPAC Name5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-6-(3-methylbut-2-enyl)chromen-4-one
Molecular FormulaC21H20O5
Molecular Weight352.4
XLogP4.9
Topological Polar Surface Area76
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity569
SMILES
CC(=CCC1=C(C=C2C(=C1O)C(=O)C(=CO2)C3=CC=C(C=C3)O)OC)C
InChI
InChI=1S/C21H20O5/c1-12(2)4-9-15-17(25-3)10-18-19(20(15)23)21(24)16(11-26-18)13-5-7-14(22)8-6-13/h4-8,10-11,22-23H,9H2,1-3H3
InChIKey
WLPHLDLTTPUDSI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Gancaonin G
CAS: 126716-34-5
CID: 480780
Formula: C21H20O5
MW: 352.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight352.4
XLogP34.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass352.13107373
Monoisotopic Mass352.13107373
Topological Polar Surface Area76 Ų
Heavy Atom Count26
Formal Charge0
Complexity569
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

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