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5-hydroxy-3,7-dimethoxy-2-phenylchromen-

CAT: 1410-M24721-01Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M24721-01Size:1 mL x 10 mM in DMSO
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
5-hydroxy-3,7-dimethoxy-2-phenylchromen-, a natural product obtained from the resinous exudate of Heliotropium huascoense.
CAS Number
70786-48-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
298.29
Molecular Formula
C17H14O5
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

5-Hydroxy-3,7-dimethoxyflavone

4H-1-Benzopyran-4-one, 5-hydroxy-3,7-dimethoxy-2-phenyl- has been reported in Boesenbergia rotunda, Heliotropium marifolium, and other organisms with data available.

CAS Number70786-48-0
PubChem CID5748697
IUPAC Name5-hydroxy-3,7-dimethoxy-2-phenylchromen-4-one
Molecular FormulaC17H14O5
Molecular Weight298.29
XLogP3.5
Topological Polar Surface Area65
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity452
SMILES
COC1=CC(=C2C(=C1)OC(=C(C2=O)OC)C3=CC=CC=C3)O
InChI
InChI=1S/C17H14O5/c1-20-11-8-12(18)14-13(9-11)22-16(17(21-2)15(14)19)10-6-4-3-5-7-10/h3-9,18H,1-2H3
InChIKey
OYCOUDKDRFJOCP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Hydroxy-3,7-dimethoxyflavone
CAS: 70786-48-0
CID: 5748697
Formula: C17H14O5
MW: 298.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight298.29
XLogP33.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass298.08412354
Monoisotopic Mass298.08412354
Topological Polar Surface Area65 Ų
Heavy Atom Count22
Formal Charge0
Complexity452
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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