Matteucinol
Basic information
- CAS
489-38-3- Standard SMILES
COc1ccc([C@@H]2CC(=O)c3c(O)c(C)c(O)c(C)c3O2)cc1- InChIKey
DZTRDRPCROOSOG-AWEZNQCLSA-N- Molecular formula
- C18H18O5
- Average molar mass
- 314.3 g/mol
- Monoisotopic mass
- 314.11542367
Overview
Matteucinol is a dihydroxyflavanone that is (2S)-flavanone with hydroxy groups at positions 5 and 7, methyl groups at positions 6 and 8 and a methoxy group at position 4'. It has a role as a radical scavenger and a plant metabolite. It is a member of 4'-methoxyflavanones, a monomethoxyflavanone and a dihydroxyflavanone. It is functionally related to a (2S)-flavanone.
Names & identifiers
- Preferred name
- Matteucinol
- IUPAC
- (2S)-5,7-dihydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-2,3-dihydrochromen-4-one
- English name
- matteucinol
- Molecular formula
- C18H18O5
- Molecular weight
- 314.33
Names & synonyms
Matteucinol489-38-34'-Methylfarrerol(2S)-5,7-dihydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-2,3-dihydrochromen-4-oneCHEBI:76323RefChem:155984CHEMBL4164421orb3179745SCHEMBL29776987DTXSID60964134BDBM50278272Q27145883
Show more names
(S)-2,3-Dihydro-5,7-dihydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-4H-1-benzopyran-4-one4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-, (2S)-
(2S)-5,7-dihydroxy-4'-methoxy-6,8-dimethylflavanone(2S)-5,7-Dihydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-2,3-dihydro-4H-1-benzopyran-4-one(2S)-5,7-dihydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-2,3-dihydro-4H-chromen-4-one5,7-Dihydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-2,3-dihydro-4H-1-benzopyran-4-one4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-, (S)-
Database identifiers
- CAS
489-38-3- PubChem CID
- 160490
- DTXSID
DTXSID60964134- ChEMBL
CHEMBL4164421- ChEBI
CHEBI:76323- Nikkaji
- J12.582B
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 431
Chemistry & industry
Additional notes
DefinitionChEBI: Matteucinol is a dihydroxyflavanone that is (2S)-flavanone with hydroxy groups at positions 5 and 7, methyl groups at positions 6 and 8 and a methoxy group at position 4'. It has a role as a radical scavenger and a plant metabolite. It is a dihydroxyflavanone, a monomethoxyflavanone and a member of 4'-methoxyflavanones. It is functionally related to a (2S)-flavanone.
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