Basic information
- CAS
123154-43-8- Standard SMILES
CC(O)C#CC#CC#CC#CCCCCCCCC(=O)O- InChIKey
MTWGWIOCIREVRF-UHFFFAOYSA-N- Molecular formula
- C18H20O3
- Average molar mass
- 284.3 g/mol
- Monoisotopic mass
- 284.1412445
Overview
17-Hydroxy-9,11,13,15-octadecatetraynoic acid is a long-chain fatty acid.
Names & identifiers
- Preferred name
- 17-Hydroxyoctadeca-9,11,13,15-tetraynoic acid
- IUPAC
- 17-hydroxyoctadeca-9,11,13,15-tetraynoic acid
Names & synonyms
17-hydroxyoctadeca-9,11,13,15-tetraynoic acidCHEMBL453190CHEBI:192306NSC692984NSC-69298417-Hydroxy-9,11,13,15-octadecatetraynoic acid
Database identifiers
- CAS
123154-43-8- PubChem CID
- 4204
- ChEMBL
CHEMBL453190- ChEBI
CHEBI:192306
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 589
Experimental & physicochemical properties
Melting Point97 °C
Physical DescriptionSolid
Chemistry & industry
Pharmacology
Cellular LocationsExtracellular
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…