Azuleno(5,6-c)furan-1(3H)-one, 4,4a,5,6,7,7a,8,9-octahydro-3,4,8-trihydroxy-6,6,8-trimethyl-
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Basic information
- CAS
71305-94-7- Standard SMILES
CC1(C)CC2C(O)C3=C(CC(C)(O)C2C1)C(=O)OC3O- InChIKey
MWDNWQAVYQDZQI-UHFFFAOYSA-N- Molecular formula
- C15H22O5
- Average molar mass
- 282.33 g/mol
- Monoisotopic mass
- 282.1467238
Overview
Azuleno(5,6-c)furan-1(3H)-one, 4,4a,5,6,7,7a,8,9-octahydro-3,4,8-trihydroxy-6,6,8-trimethyl- is a terpene lactone.
Names & identifiers
- Preferred name
- Azuleno(5,6-c)furan-1(3H)-one, 4,4a,5,6,7,7a,8,9-octahydro-3,4,8-trihydroxy-6,6,8-trimethyl-
- IUPAC
- 1,5,9-trihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-one
- English name
- 4,4a,5,6,7,7a,8,9-Octahydro-3,4,8-trihydroxy-6,6,8-trimethylazuleno[5,6-c]furan-1(3H)-one
- Molecular weight
- 0
Names & synonyms
71305-94-7Azuleno(5,6-c)furan-1(3H)-one, 4,4a,5,6,7,7a,8,9-octahydro-3,4,8-trihydroxy-6,6,8-trimethyl-1,5,9-trihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]furan-3-oneCompound NP-015023orb3171782DTXSID20991608CHEBI:182842AKOS040738817NCGC00385445-014,4a,5,6,7,7a,8,9-Octahydro-3,4,8-trihydroxy-6,6,8-trimethylazuleno[5,6-c]furan-1(3H)-oneT1297311,5,9-trihydroxy-5,7,7-trimethyl-4,5a,6,8,8a,9-hexahydro-1H-azuleno[5,6-c]uran-3-one
Show more names
Lactarolide A
3,4,8-Trihydroxy-6,6,8-trimethyl-4,4a,5,6,7,7a,8,9-octahydroazuleno[5,6-c]furan-1(3H)-one
Database identifiers
- CAS
71305-94-7- PubChem CID
- 156145
- DTXSID
Properties
Computed structural propertiesFilling in
- XLogP
- 0.2
- Topological polar surface area
- 87 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 494
Chemistry & industry
Additional notes
DefinitionChEBI: Azuleno(5,6-c)furan-1(3H)-one, 4,4a,5,6,7,7a,8,9-octahydro-3,4,8-trihydroxy-6,6,8-trimethyl- is a terpene lactone.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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