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Veronicafolin

CAT: 0013-GTR19255816-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19255816-02Size:50 mg
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Description
Veronicafolin is a flavonol compound that can be found in Brickellia veronicaefolia.
CAS Number
19587-65-6
Smiles
O=C1C (O) =C (OC=2C=C (OC) C (OC) =C (O) C12) C=3C=CC (OC) =C (O) C3
Molecular Formula
C18H16O8
Molecular Weight
360.315
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Eupatin

Eupatin is a trimethoxyflavone that is quercetagetin methylated at positions 4', 6 and 7. It is a trihydroxyflavone, a trimethoxyflavone and a member of flavonols. It is functionally related to a quercetagetin.

CAS Number19587-65-6
PubChem CID5317287
IUPAC Name3,5-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxychromen-4-one
Molecular FormulaC18H16O8
Molecular Weight360.3
XLogP2.8
Topological Polar Surface Area115
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity561
SMILES
COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)O)O)O
InChI
InChI=1S/C18H16O8/c1-23-10-5-4-8(6-9(10)19)17-16(22)14(20)13-11(26-17)7-12(24-2)18(25-3)15(13)21/h4-7,19,21-22H,1-3H3
InChIKey
ZZEQOHMDRQUMMH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Eupatin
CAS: 19587-65-6
CID: 5317287
Formula: C18H16O8
MW: 360.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight360.3
XLogP32.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass360.08451746
Monoisotopic Mass360.08451746
Topological Polar Surface Area115 Ų
Heavy Atom Count26
Formal Charge0
Complexity561
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
TN10481-01Veronicafolin

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