Isoginkgetin

C₃₂H₂₂O₁₀CAS 548-19-6566.52 g/mol

Open in Covalent MOL file

Ether Phenol

Properties

Molecular formula: C₃₂H₂₂O₁₀
Molar mass: 566.52 g/mol
Exact mass: 566.1213 Da
Melting point: 355 °C
logP: 5.74Crippen estimate
Polar surface area: 159.8 Å²
H-bond donors / acceptors: 4 / 10
Rotatable bonds: 5

Identifiers

CAS number

548-19-6

SMILES

COc1ccc(-c2cc(=O)c3c(O)cc(O)c(-c4cc(-c5cc(=O)c6c(O)cc(O)cc6o5)ccc4OC)c3o2)cc1

InChIKey

HUOOMAOYXQFIDQ-UHFFFAOYSA-N

InChI

InChI=1S/C32H22O10/c1-39-18-6-3-15(4-7-18)26-14-24(38)31-22(36)12-21(35)29(32(31)42-26)19-9-16(5-8-25(19)40-2)27-13-23(37)30-20(34)10-17(33)11-28(30)41-27/h3-14,33-36H,1-2H3

Weigh it out

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

Names and synonyms

4 names

4H-1-Benzopyran-4-one, 8-[5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-methoxyphenyl]-5,7-dihydroxy-2-(4-methoxyphenyl)-
3′′′,8-Biflavone, 5,5′′,7,7′′-tetrahydroxy-4′,4′′′-dimethoxy-
8-[5-(5,7-Dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-methoxyphenyl]-5,7-dihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
4′,4′′′-Dimethylamentoflavone

Work with Isoginkgetin

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

Bilobetin521-32-490 % similar Sciadopitysin521-34-687 % similar Acacetin480-44-472 % similar Amentoflavone1617-53-469 % similar Diosmetin520-34-367 % similar Chrysoeriol491-71-464 % similar Genkwanin437-64-958 % similar Tricin520-32-157 % similar

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

Same formula

Ginkgetin481-46-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook