Kurospongin
Basic information
- CAS
115722-54-8- Standard SMILES
C/C(=C\CCc1ccoc1)C[C@H]1C=C(C/C=C/c2ccoc2)C(=O)O1- InChIKey
RSURXMFKHSIZSB-NVMYMJKRSA-N- Molecular formula
- C21H22O4
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.15180918
Overview
(2S)-2-[(E)-5-(furan-3-yl)-2-methylpent-2-enyl]-4-[(E)-3-(furan-3-yl)prop-2-enyl]-2H-furan-5-one has been reported in Ircinia and Spongia with data available.
Names & identifiers
- Preferred name
- Kurospongin
- IUPAC
- (2S)-2-[(E)-5-(furan-3-yl)-2-methylpent-2-enyl]-4-[(E)-3-(furan-3-yl)prop-2-enyl]-2H-furan-5-one
Names & synonyms
Kurospongin115722-54-82(5H)-Furanone, 5-(5-(3-furanyl)-2-methyl-2-pentenyl)-3-(3-(3-furanyl)-2-propenyl)-, (S-(E,E))-
Database identifiers
- CAS
115722-54-8- PubChem CID
- 6443340
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 546
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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