chempirical

Oroxylin A

C16H12O5CAS 480-11-5284.27 g/mol

Open in Covalent MOL file
OHOOOHO
EtherPhenol

Properties

Molecular formula
C16H12O5
Molar mass
284.27 g/mol
Exact mass
284.0685 Da
Melting point
231–232 °C
logP
2.88Crippen estimate
Polar surface area
79.9 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
480-11-5
SMILES
COc1c(O)cc2oc(-c3ccccc3)cc(=O)c2c1O
InChIKey
LKOJGSWUMISDOF-UHFFFAOYSA-N
InChI
InChI=1S/C16H12O5/c1-20-16-11(18)8-13-14(15(16)19)10(17)7-12(21-13)9-5-3-2-4-6-9/h2-8,18-19H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • 4H-1-Benzopyran-4-one, 5,7-dihydroxy-6-methoxy-2-phenyl-
  • Flavone, 5,7-dihydroxy-6-methoxy-
  • Oroxylin
  • 5,7-Dihydroxy-6-methoxy-2-phenyl-4H-1-benzopyran-4-one
  • 6-Methoxybaicalein
  • 5,7-Dihydroxy-6-methoxyflavone
  • Baicalein 6-methyl ether

Work with Oroxylin A

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

Hispidulin1447-88-781 % similar Pectolinarigenin520-12-781 % similar Nepetin520-11-679 % similar Mosloflavone740-33-079 % similar Jaceosidin18085-97-776 % similar Eupatilin22368-21-474 % similar Baicalein491-67-871 % similar Techtochrysin520-28-567 % similar

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

Same formula

(-)-Maackiain19908-48-6 (-)-Maackiain2035-15-6 Calycosin20575-57-9 Glycitein40957-83-3 Genkwanin437-64-9 Obtusifolin477-85-0 Acacetin480-44-4 Biochanin A491-80-5

Elsewhere

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