Basic information
- CAS
2091-25-0- Standard SMILES
CCCCCC=CCC=CCC=CCC=CCCCCCC(=O)O- InChIKey
TWSWSIQAPQLDBP-UHFFFAOYSA-N- Molecular formula
- C22H36O2
- Average molar mass
- 332.5 g/mol
- Monoisotopic mass
- 332.27153039
Overview
7,10,13,16-docosatetraenoic acid is a docosatetraenoic acid in which the four double bonds are located at positions 7, 10, 13 and 16 (geometry unspecified). It has a role as a mouse metabolite.
Names & identifiers
- Preferred name
- Docosa-7,10,13,16-tetraenoic acid
- IUPAC
- docosa-7,10,13,16-tetraenoic acid
Names & synonyms
7,10,13,16-Docosatetraenoic aciddocosa-7,10,13,16-tetraenoic acid28874-58-0Adrenic Acid (22:4, n-6)Docosa-7z,10z,13z,16z-pentaenoic acidCBiol_001990KBioGR_000219KBioSS_0002197,10,13,16-docosatetraenoic acid, (7Z,10Z,13Z,16Z)-SCHEMBL278030KBio2_000219KBio2_002787
Show more names
KBio2_005355KBio3_000437KBio3_000438DTXSID60862828CHEBI:131693TWSWSIQAPQLDBP-UHFFFAOYSA-NBio1_000276Bio1_000765
Database identifiers
- CAS
2091-25-0- PubChem CID
- 2033
- DTXSID
DTXSID60862828- ChEBI
CHEBI:131693
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 16
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 389
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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