1-(Furan-3-yl)-7-hydroxy-4,8-dimethylnonane-1,6-dione
Basic information
- CAS
52259-61-7- Standard SMILES
CC(CCC(=O)c1ccoc1)CC(=O)C(O)C(C)C- InChIKey
HCPDJZNVPUCXHZ-UHFFFAOYSA-N- Molecular formula
- C15H22O4
- Average molar mass
- 266.33 g/mol
- Monoisotopic mass
- 266.15180918
Overview
10-Hydroxymyoporone is an aliphatic alcohol.
Names & identifiers
- Preferred name
- 1-(Furan-3-yl)-7-hydroxy-4,8-dimethylnonane-1,6-dione
- IUPAC
- 1-(furan-3-yl)-7-hydroxy-4,8-dimethylnonane-1,6-dione
Names & synonyms
10-HydroxymyoporoneMYOPORONE, 7-HYDROXY1-(furan-3-yl)-7-hydroxy-4,8-dimethylnonane-1,6-dioneNSC2569457-HYDROXY-MYOPORONE1-furan-3-yl-7-hydroxy-4,8-dimethylnonane-1,6-dioneSCHEMBL22501689DTXSID70966629CHEBI:174496AKOS0159050951-(3-furyl)-7-hydroxy-4,8-dimethyl-1,6-nonanedione1-(uran-3-yl)-7-hydroxy-4,8-dimethylnonane-1,6-dione
Database identifiers
- CAS
52259-61-7- PubChem CID
- 40303
- DTXSID
DTXSID70966629- ChEBI
CHEBI:174496- Nikkaji
- J59.354K
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 311
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
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Related reactions
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Compound notes
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