(Z)-7-[(1R)-2-[(1E,3S,5Z)-3-hydroxyocta-1,5-dienyl]-5-oxocyclopent-2-en-1-yl]hept-5-enoic acid
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Basic information
- CAS
52590-97-3- Standard SMILES
CC/C=C\C[C@H](O)/C=C/C1=CCC(=O)[C@@H]1C/C=C\CCCC(=O)O- InChIKey
ZIFWTSFMNWFLAJ-PZUFVIJHSA-N- Molecular formula
- C20H28O4
- Average molar mass
- 332.4 g/mol
- Monoisotopic mass
- 332.19875937
Names & identifiers
- Preferred name
- (Z)-7-[(1R)-2-[(1E,3S,5Z)-3-hydroxyocta-1,5-dienyl]-5-oxocyclopent-2-en-1-yl]hept-5-enoic acid
- IUPAC
- (Z)-7-[(1R)-2-[(1E,3S,5Z)-3-hydroxyocta-1,5-dienyl]-5-oxocyclopent-2-en-1-yl]hept-5-enoic acid
- English name
- (5Z,13E,15S,17Z)-15-Hydroxy-9-oxoprosta-5,11,13,17-tetraen-1-oic acid
- Molecular formula
- C20H28O4
- Molecular weight
- 332.43
Names & synonyms
PGC3Prostaglandin C3(5Z,13E,15S,17Z)-15-Hydroxy-9-oxoprosta-5,11,13,17-tetraen-1-oic acidProsta-5,11,13,17-tetraen-1-oic acid, 15-hydroxy-9-oxo-, (5Z,13E,15S,17Z)-
Database identifiers
- CAS
52590-97-3- PubChem CID
- 90473169
- Nikkaji
- J39.536F
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 526
Related reactions
0 records
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Compound notes
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