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Luteolin 7,3',4'-trimethyl ether

CAT: 1407-AB3113Size: 20 mgDry Ice: NoHazardous: No
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CAT#:1407-AB3113Size:20 mg
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CAS Number
29080-58-8
Purity
98% (HPLC)
Molecular Formula
C18H16O6
Molecular Weight
328.32

Chemical Information

Gonzalitosin I

7,3',4'-Tri-O-methylluteolin has been reported in Veratrum dahuricum, Salvia euphratica, and other organisms with data available.

CAS Number29080-58-8
PubChem CID5272653
IUPAC Name2-(3,4-dimethoxyphenyl)-5-hydroxy-7-methoxychromen-4-one
Molecular FormulaC18H16O6
Molecular Weight328.3
XLogP2.4
Topological Polar Surface Area74.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity490
SMILES
COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC)O)OC
InChI
InChI=1S/C18H16O6/c1-21-11-7-12(19)18-13(20)9-15(24-17(18)8-11)10-4-5-14(22-2)16(6-10)23-3/h4-9,19H,1-3H3
InChIKey
HIXDQWDOVZUNNA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Gonzalitosin I
CAS: 29080-58-8
CID: 5272653
Formula: C18H16O6
MW: 328.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight328.3
XLogP32.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass328.09468823
Monoisotopic Mass328.09468823
Topological Polar Surface Area74.2 Ų
Heavy Atom Count24
Formal Charge0
Complexity490
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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Alternative Products

CatalogName
MBS8506263-01Diosmetin (Luteolin 4-methyl ether)
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TB03000Kaempferol 3,7,4'-trimethyl ether
FK65525-01Kaempferol-3,7,4'-trimethyl ether
FO65379Orobol 7,3',4'-trimethyl ether
MBS3617645-01Kaempferol 3,7,4-trimethyl ether
BAA09892-01Kaempferol 5,7,4'-trimethyl ether
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