Basic information
- Standard SMILES
CC(C)=CCCCCC(O)C=C[C@H]1C(O)CC2CC(=CCCCC(=O)O)C[C@@H]21- InChIKey
RYDGJENGFVUSKA-XGRXMRGWSA-N- Molecular formula
- C24H38O4
- Average molar mass
- 390.6 g/mol
- Monoisotopic mass
- 390.27700969
Names & identifiers
- Preferred name
- 6,9-Methylene-11,15-dihydroxy-20-isopropylideneprost-5,13-dienoic acid
- IUPAC
- 5-[(3aS,4R)-5-hydroxy-4-(3-hydroxy-9-methyldeca-1,8-dienyl)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]pentanoic acid
Names & synonyms
SCHEMBL9644760RYDGJENGFVUSKA-XGRXMRGWSA-N6,9-methylene-11,15-dihydroxy-20-isopropylideneprost-5,13-dienoic acid
Database identifiers
- PubChem CID
- 54291968
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 585
Related reactions
1 records
Compound notes
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