13,14-Dihydroprostaglandin E2
Basic information
- CAS
363-22-4- Standard SMILES
CCCCC[C@H](O)CC[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O- InChIKey
PSUXJJCBYWUFQC-KSNMPCKYSA-N- Molecular formula
- C20H34O5
- Average molar mass
- 354.5 g/mol
- Monoisotopic mass
- 354.24062418
Names & identifiers
- Preferred name
- 13,14-Dihydroprostaglandin E2
- IUPAC
- (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(3S)-3-hydroxyoctyl]-5-oxocyclopentyl]hept-5-enoic acid
- English name
- 13,14-dihydroprostaglandin E2
- Molecular formula
- C20H34O5
- Molecular weight
- 354.48096
Names & synonyms
13,14-Dihydroprostaglandin E213,14-Dihydro-PGE2363-22-4U-42170Prost-5-en-1-oic acid, 11,15-dihydroxy-9-oxo-, (5Z,11alpha,15S)-RefChem:78371(Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(3S)-3-hydroxyoctyl]-5-oxocyclopentyl]hept-5-enoic acidU 42170SCHEMBL16691829
Database identifiers
- CAS
363-22-4- PubChem CID
- 6440934
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 94.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 432
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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