Eleutherol
Basic information
- CAS
480-00-2- Standard SMILES
COc1cccc2cc3c(c(O)c12)[C@@H](C)OC3=O- InChIKey
KNLHGXVYZRQSJZ-SSDOTTSWSA-N- Molecular formula
- C14H12O4
- Average molar mass
- 244.24 g/mol
- Monoisotopic mass
- 244.07355886
Overview
Eleutherol is a naphthofuran.
Names & identifiers
- Preferred name
- Eleutherol
- IUPAC
- (3R)-4-hydroxy-5-methoxy-3-methyl-3H-benzo[f][2]benzofuran-1-one
- English name
- Eleutherol
- Molecular formula
- C14H12O4
- Molecular weight
- 244.24
Names & synonyms
Eleutherol480-00-2DTXSID50197373(3R)-4-hydroxy-5-methoxy-3-methyl-3H-benzo[f][2]benzofuran-1-one(3R)-4-hydroxy-5-methoxy-3-methyl-3H-benzo(f)(2)benzofuran-1-oneRefChem:136486DTXCID60119864(R)-4-Hydroxy-5-methoxy-3-methylnaphtho[2,3-c]furan-1(3H)-one(R)-4-Hydroxy-5-methoxy-3-methylnaphtho(2,3-c)furan-1(3H)-one(3r)-4-hydroxy-5-methoxy-3-methylnaphtho[2,3-c]furan-1(3h)-oneNaphtho(2,3-c)furan-1(3H)-one, 4-hydroxy-5-methoxy-3-methyl-, (R)-orb1684138
Show more names
Naphtho[2,3-c]furan-1(3H)-one, 4-hydroxy-5-methoxy-3-methyl-, (3R)-
SCHEMBL29522526CHEBI:181604HY-N7626TN2339AKOS030532565AC-34299DA-63151CS-0134821
Database identifiers
- CAS
480-00-2- PubChem CID
- 120697
- DTXSID
DTXSID50197373- ChEBI
CHEBI:181604- Nikkaji
- J12.432J
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 343
Physicochemical properties
- storage temp.
- -20 °C · Store at -20°C
- form
- Solid
- color
- Off-white to yellow
Chemistry & industry
Applications
UsesEleutherol is a naphthalene isolated from E. americana with antifungal activities[1]. Eleutherol is against yeasts Candida albicans, C. tropicalis, Saccharomyces cerevisiae and Cryptococcus neoformans with MIC values between 7.8 μg/mL and 250 μg/mL[1]. Eleutherol inhibits α-glucosidase function with an IC50>1.00 mM[2].
Additional notes
DefinitionChEBI: Eleutherol is a naphthofuran.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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