chempirical

Luteolin 7-methyl ether

C16H12O6CAS 20243-59-8300.27 g/mol

Open in Covalent MOL file
OOHOOHOHO
EtherPhenol

Properties

Molecular formula
C16H12O6
Molar mass
300.27 g/mol
Exact mass
300.0634 Da
Melting point
258–260 °C
logP
2.59Crippen estimate
Polar surface area
100.1 Ų
H-bond donors / acceptors
3 / 6
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
20243-59-8
SMILES
COc1cc(O)c2c(=O)cc(-c3ccc(O)c(O)c3)oc2c1
InChIKey
RRRSSAVLTCVNIQ-UHFFFAOYSA-N
InChI
InChI=1S/C16H12O6/c1-21-9-5-12(19)16-13(20)7-14(22-15(16)6-9)8-2-3-10(17)11(18)4-8/h2-7,17-19H,1H3

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Names and synonyms

10 names
  • 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-
  • Flavone, 3′,4′,5-trihydroxy-7-methoxy-
  • 2-(3,4-Dihydroxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one
  • 7-O-Methylluteolin
  • 3′,4′,5-Trihydroxy-7-methoxyflavone
  • 3′-Hydroxygenkwanin
  • 5,3′,4′-Trihydroxy-7-methoxyflavone
  • Hydroxygenkwanin
  • 2-(3,4-Dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one
  • 2-(3,4-Dihydroxyphenyl)-5-hydroxy-7-methoxy-4H-chromen-4-one

Work with Luteolin 7-methyl ether

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-Hydroxy-3',4',7-trimethoxyflavone29080-58-879 % similar Genkwanin437-64-978 % similar Techtochrysin520-28-576 % similar Nepetin520-11-669 % similar Luteolin491-70-367 % similar Acacetin480-44-467 % similar Sciadopitysin521-34-663 % similar Pectolinarigenin520-12-762 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Hispidulin1447-88-7 Geraldol21511-25-1 Kaempferide491-54-3 Chrysoeriol491-71-4 Diosmetin520-34-3 Acetylsalicylsalicylic acid530-75-6 Tectorigenin548-77-6 Rhamnocitrin569-92-6

Elsewhere

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