Oroselone
Basic information
- CAS
1760-27-6- Standard SMILES
C=C(C)c1cc2c(ccc3ccc(=O)oc32)o1- InChIKey
FQCPXIJRWHRHIP-UHFFFAOYSA-N- Molecular formula
- C14H10O3
- Average molar mass
- 226.23 g/mol
- Monoisotopic mass
- 226.06299418
Overview
Oroselone is a furanocoumarin.
Names & identifiers
- Preferred name
- Oroselone
- IUPAC
- 8-prop-1-en-2-ylfuro[2,3-h]chromen-2-one
- English name
- Oroselone
- Molecular formula
- C14H10O3
- Molecular weight
- 226.23
Names & synonyms
Oroselone1760-27-6MXB3B7X85P2H-Furo(2,3-h)-1-benzopyran-2-one, 8-(1-methylethenyl)-8-(1-Methylethenyl)-2H-furo(2,3-h)-1-benzopyran-2-one8-(PROP-1-EN-2-YL)-2H-FURO[2,3-H]CHROMEN-2-ONEDTXSID301700638-(1-Methylethenyl)-2H-Furo[2,3-h]-1-benzopyran-2-one2H-FURO[2,3-H]-1-BENZOPYRAN-2-ONE, 8-(1-METHYLETHENYL)-8-(prop-1-en-2-yl)-2H-furo(2,3-h)chromen-2-oneRefChem:1093906DTXCID8092554
Show more names
8-prop-1-en-2-ylfuro[2,3-h]chromen-2-oneKvannin2H-Furo[2,3-h]-1-benzopyran-2-one, 8-isopropenyl-HMS2270F065'-IsopropenylangelicinUNII-MXB3B7X85PMLS0024729358-Isopropenyl-2H-Furo[2,3-h]-1-benzopyran-2-one
Database identifiers
- CAS
1760-27-6- PubChem CID
- 74477
- DTXSID
DTXSID30170063- ChEMBL
CHEMBL1708543- ChEBI
CHEBI:174165- UNII
- MXB3B7X85P
- Nikkaji
- J104.648I
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 385
Experimental & physicochemical properties
Melting Point188 - 189 °C
Physical DescriptionSolid
Physicochemical properties
- FDA UNII
- 3 B7X85P · MXB3B7X85P
Chemistry & industry
Pharmacology
Cellular LocationsMembrane
Additional notes
DefinitionChEBI: Oroselone is a furanocoumarin.
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Related reactions
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Compound notes
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