Basic information
- CAS
21661-11-0- Standard SMILES
CC/C=C\C/C=C/C/C=C/CCCCCCCC(=O)O- InChIKey
DTOSIQBPPRVQHS-YSFKBSJESA-N- Molecular formula
- C18H30O2
- Average molar mass
- 278.4 g/mol
- Monoisotopic mass
- 278.2245802
Overview
9E,12E,15Z-octadecatrienoic acid is an octadecatrienoic acid.
Names & identifiers
- Preferred name
- alpha-Linolenic Acid, (E,E,Z)-
- IUPAC
- (9E,12E,15Z)-octadeca-9,12,15-trienoic acid
Names & synonyms
21661-13-2RefChem:915537alpha-Linolenic Acid, (E,E,Z)-9E,12E,15Z-octadecatrienoic acid(9E,12E,15Z)-octadeca-9,12,15-trienoic acidCHEBI:180183DTXSID001358058LMFA01030348(E,E,Z)-9,12,15-Octadecatrienoic Acid9,12,15-Octadecatrienoic acid, (E,E,Z)-9,12,15-Octadecatrienoic acid, (Z,E,E)-
Database identifiers
- CAS
21661-11-0、21661-13-2- PubChem CID
- 5312499
- DTXSID
DTXSID001358058- ChEBI
CHEBI:180183- Nikkaji
- J694.843J
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 13
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 301
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Unsaturated fatty acids [FA0103]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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