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Methylophiopogonone A

CAT: 1410-M19069-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M19069-01Size:5 mg
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Description
Methylophiopogonone A, a homoisoflavonoid isolated from the tuberous roots of Ophiopogon japonicas, shows anti-inflammatory activity.
CAS Number
74805-90-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
340.32
Molecular Formula
C19H16O6
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Methylophiopogonone A

Methylophiopogonone A is a homoisoflavonoid that is 4H-1-benzopyran-4-one substituted by hydroxy groups at positions 5 and 7, methyl groups at positions 6 and 8 and a (2H-1,3-benzodioxol-5-yl)methyl group at position 3 respectively. It has a role as a plant metabolite. It is a member of resorcinols and a homoisoflavonoid.

CAS Number74805-90-6
PubChem CID10065830
IUPAC Name3-(1,3-benzodioxol-5-ylmethyl)-5,7-dihydroxy-6,8-dimethylchromen-4-one
Molecular FormulaC19H16O6
Molecular Weight340.3
XLogP3.9
Topological Polar Surface Area85.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count25
Formal Charge0
Complexity560
SMILES
CC1=C(C(=C2C(=C1O)C(=O)C(=CO2)CC3=CC4=C(C=C3)OCO4)C)O
InChI
InChI=1S/C19H16O6/c1-9-16(20)10(2)19-15(17(9)21)18(22)12(7-23-19)5-11-3-4-13-14(6-11)25-8-24-13/h3-4,6-7,20-21H,5,8H2,1-2H3
InChIKey
AUTZLTCWRDPAPV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methylophiopogonone A
CAS: 74805-90-6
CID: 10065830
Formula: C19H16O6
MW: 340.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight340.3
XLogP33.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass340.09468823
Monoisotopic Mass340.09468823
Topological Polar Surface Area85.2 Ų
Heavy Atom Count25
Formal Charge0
Complexity560
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

Related Products

CatalogName
M19071-01Methylophiopogonanone A
M19070-01Methylophiopogonanone B

Alternative Products

CatalogName
TB0822-0250Methylophiopogonone A
TN1050-01Methylophiopogonone B
371688Methylophiopogonone A discontinued
HY-N2441RMethylophiopogonone A (Standard)

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