Basic information
- Standard SMILES
CCCCCC(=O)C=CC1C(O)CC(=O)C1CCCCCCC(=O)O- InChIKey
VXPBDCBTMSKCKZ-UHFFFAOYSA-N- Molecular formula
- C20H32O5
- Average molar mass
- 352.5 g/mol
- Monoisotopic mass
- 352.22497412
Names & identifiers
- Preferred name
- 7-(3-Hydroxy-5-oxo-2-(3-oxooct-1-enyl)cyclopentyl)heptanoic acid
- IUPAC
- 7-[3-hydroxy-5-oxo-2-(3-oxooct-1-enyl)cyclopentyl]heptanoic acid
Names & synonyms
RefChem:10743257-(3-Hydroxy-5-oxo-2-(3-oxooct-1-enyl)cyclopentyl)heptanoic acidSCHEMBL11866030PD051112
Database identifiers
- PubChem CID
- 14
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 91.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 469
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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