5,7,4'-Trihydroxy-8-methylflavanone

C₁₆H₁₄O₅CAS 916917-28-7286.28 g/mol

Open in Covalent MOL file

Ether Ketone Phenol

Properties

Molecular formula: C₁₆H₁₄O₅
Molar mass: 286.28 g/mol
Exact mass: 286.0841 Da
logP: 2.82Crippen estimate
Polar surface area: 87.0 Å²
H-bond donors / acceptors: 3 / 5
Rotatable bonds: 1

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

916917-28-7

SMILES

CC1=C2C(=C(C=C1O)O)C(=O)CC(O2)C3=CC=C(C=C3)O

InChIKey

GMVYLXBMPRDZDR-UHFFFAOYSA-N

InChI

InChI=1S/C16H14O5/c1-8-11(18)6-12(19)15-13(20)7-14(21-16(8)15)9-2-4-10(17)5-3-9/h2-6,14,17-19H,7H2,1H3

Weigh it out

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Work with 5,7,4'-Trihydroxy-8-methylflavanone

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

(-)-Farrerol24211-30-169 % similar 8-Prenylnaringenin53846-50-767 % similar Naringenin480-41-163 % similar (+-)-Naringenin67604-48-263 % similar (+-)-Naringenin93602-28-963 % similar Isoxanthohumol70872-29-653 % similar (+)-Pinocembrin480-39-753 % similar Eriodictyol552-58-952 % similar

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

Same formula

Phenoxyacetic anhydride14316-61-1 (+)-Heraclenin2880-49-1 Sakuranetin2957-21-3 Dibenzyl pyrocarbonate31139-36-3 Brazilin474-07-7 Isosakuranetin480-43-3 Guacetisal55482-89-8 Licochalcone B58749-23-8

Elsewhere

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