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Basic information
- CAS
81246-84-6- Standard SMILES
CCCCCC=CCC=CCC=CCC1OC1CCCC(=O)O- InChIKey
VBQNSZQZRAGRIX-UHFFFAOYSA-N- Molecular formula
- C20H32O3
- Average molar mass
- 320.5 g/mol
- Monoisotopic mass
- 320.23514488
Names & identifiers
- Preferred name
- 4-[3-(Tetradeca-2,5,8-trien-1-yl)oxiran-2-yl]butanoic acid
- IUPAC
- 4-(3-tetradeca-2,5,8-trienyloxiran-2-yl)butanoic acid
Names & synonyms
4-[3-(tetradeca-2,5,8-trien-1-yl)oxiran-2-yl]butanoic acid5,6-epoxyeicosa-8,11,14-trienoic acid81246-84-65(6)-EpETrE(+/-)5,6-EET(+/-)5,6-EPOXYEICOSA-8Z,11Z,14Z-TRIENOIC ACIDCBiol_001855KBioGR_000167KBioSS_000167SCHEMBL25089394-(3-tetradeca-2,5,8-trienyloxiran-2-yl)butanoic acidKBio2_000167
Show more names
KBio2_002735KBio2_005303KBio3_000333KBio3_000334DTXSID20868604Bio1_000141Bio1_000630Bio1_001119
Database identifiers
- CAS
81246-84-6- PubChem CID
- 1778
- DTXSID
DTXSID20868604
Properties
Computed structural propertiesFilling in
- XLogP
- 5.5
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 14
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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