Terminology Service for NFDI4Health
JSON

(7Z,10Z,13Z,15E,19Z)-17-oxodocosapentaenoate

Go to external page http://purl.obolibrary.org/obo/CHEBI_140333

A docosanoid anion that is the conjugate base of (7Z,10Z,13Z,15E,19Z)-17-oxodocosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.

Term info

Label

(7Z,10Z,13Z,15E,19Z)-17-oxodocosapentaenoate

Synonyms
  • (7Z,10Z,13Z,15E,19Z)-17-oxodocosa-7,10,13,15,19-pentaenoate
Subsets

3_STAR

IUPAC NAME
(7Z,10Z,13Z,15E,19Z)-17-oxodocosa-7,10,13,15,19-pentaenoate [ IUPAC ]

charge

-1

formula

C22H31O3

has obo namespace

chebi_ontology

has related synonym

17-oxo-(7Z,10Z,13Z,15E,19Z)-docosapentaenoate, 17-oxo-omega3-docosapentaenoate, 17-oxo-DPA(n-3)(1-)

id

CHEBI:140333

inchi

InChI=1S/C22H32O3/c1-2-3-15-18-21(23)19-16-13-11-9-7-5-4-6-8-10-12-14-17-20-22(24)25/h3,5-8,11,13,15-16,19H,2,4,9-10,12,14,17-18,20H2,1H3,(H,24,25)/p-1/b7-5-,8-6-,13-11-,15-3-,19-16+

inchikey

PWVSFTLICCBISU-UCMLWGQMSA-M

mass

343.481

monoisotopicmass

343.22787

smiles

C(C([O-])=O)CCCC/C=C\C/C=C\C/C=C\C=C\C(C/C=C\CC)=O