chempirical

Gossypetin

C15H10O8CAS 489-35-0318.24 g/mol

Open in Covalent MOL file
OOHOHOHOOHHOOH
Phenol

Properties

Molecular formula
C15H10O8
Molar mass
318.24 g/mol
Exact mass
318.0376 Da
Melting point
311–330 °C
logP
1.69Crippen estimate
Polar surface area
151.6 Ų
H-bond donors / acceptors
6 / 8
Rotatable bonds
1

Identifiers

CAS number
489-35-0
SMILES
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2c(O)c(O)cc(O)c12
InChIKey
YRRAGUMVDQQZIY-UHFFFAOYSA-N
InChI
InChI=1S/C15H10O8/c16-6-2-1-5(3-7(6)17)14-13(22)12(21)10-8(18)4-9(19)11(20)15(10)23-14/h1-4,16-20,22H

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Names and synonyms

9 names
  • 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3,5,7,8-tetrahydroxy-
  • Flavone, 3,3′,4′,5,7,8-hexahydroxy-
  • 2-(3,4-Dihydroxyphenyl)-3,5,7,8-tetrahydroxy-4H-1-benzopyran-4-one
  • C.I. 75750
  • Equisporol
  • 8-Hydroxyquercetin
  • Articulatidin
  • 2-(3,4-Dihydroxyphenyl)-3,5,7,8-tetrahydroxychromen-4-one
  • 3,5,7,8,3′,4′-Hexahydroxyflavone

Work with Gossypetin

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

Herbacetin527-95-776 % similar Quercetin117-39-564 % similar Quercetin dihydrate6151-25-360 % similar Rhamnetin90-19-758 % similar Fisetin528-48-354 % similar Kaempferol520-18-350 % similar Isorhamnetin480-19-347 % similar Tamarixetin603-61-247 % similar

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

Same formula

Myricetin529-44-2 Quercetagetin90-18-6

Elsewhere

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