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Wighteone

CAT: 0931-TN5254-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TN5254-03Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
51225-30-0
Target
Antifungal
Related Pathways
Microbiology/Virology
Purity
0.9895
Bioactivity
Wighteone (Erythrinin B) is a small molecule compound derived from Genista ephedroides with potential antifungal and anticancer activity against EGFR L858R/T790M mutant non-small cell lung cancer.
Smiles
O=C1C(=COC2=CC(O)=C(C(O)=C12)CC=C(C)C)C=3C=CC(O)=CC3
Molecular Formula
C20H18O5
Molecular Weight
338.35
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Wighteone

Wighteone is a member of the class of 7-hydroxyisoflavones that is isoflavone substituted by hydroxy groups at positions 5, 7 and 4' and a prenyl group at position 6. It has been isolated from Ficus mucuso. It has a role as an antifungal agent and a plant metabolite. It is functionally related to an isoflavone.

CAS Number51225-30-0
PubChem CID5281814
IUPAC Name5,7-dihydroxy-3-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)chromen-4-one
Molecular FormulaC20H18O5
Molecular Weight338.4
XLogP4.6
Topological Polar Surface Area87
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity554
SMILES
CC(=CCC1=C(C2=C(C=C1O)OC=C(C2=O)C3=CC=C(C=C3)O)O)C
InChI
InChI=1S/C20H18O5/c1-11(2)3-8-14-16(22)9-17-18(19(14)23)20(24)15(10-25-17)12-4-6-13(21)7-5-12/h3-7,9-10,21-23H,8H2,1-2H3
InChIKey
KIMDVVKVNNSHGZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Wighteone
CAS: 51225-30-0
CID: 5281814
Formula: C20H18O5
MW: 338.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight338.4
XLogP34.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass338.11542367
Monoisotopic Mass338.11542367
Topological Polar Surface Area87 Ų
Heavy Atom Count25
Formal Charge0
Complexity554
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
FW138624-01Wighteone

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