Exploring Phylogenetic Relationships between Hundreds of Plant Fatty Acids Synthesized by Thousands of Plants. more details ...

Delta notation: 18:4-delta-9t,11t,13t,15t

Other Names: 9,11,13,15-Octadecatetraenoic acid, (all-E)-; 9-trans,11-trans,13-trans,15-trans-Octadecatetraenoic acid; trans-Parinaric acid; β-PAC; β-Parinaric acid

Formula: C18 H28 O2

Mass: 276.41

9,11,13,15 octadecatetraenoic acid, (9e,11e,13e,15e)
Structure drawn at OPSIN (opsin.ch.cam.uk)

External Database IDs:
CAS registry: 18841-21-9
SOFA Mol: M_118
Lipid Maps: LMFA01030171
PubChem: 107981
ChEBI:

inchi: InChI=1/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-10H,2,11-17H2,1H3,(H,19,20)/b4-3+,6-5+,8-7+,10-9+/f/h19H

stdinchi: InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-10H,2,11-17H2,1H3,(H,19,20)/b4-3+,6-5+,8-7+,10-9+

stdinchikey: IJTNSXPMYKJZPR-BYFNFPHLSA-N

smiles: C(CCCCCCC\C=C\C=C\C=C\C=C\CC)(=O)O


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