Terminology Service for NFDI4Health
JSON

cholesteryl (5Z,8Z,11Z,14Z,17Z-eicosapentaenoate)

Go to external page http://purl.obolibrary.org/obo/CHEBI_84969

A cholesterol ester obtained by the formal condensation of cholesterol with all-cis-5,8,11,14,17-icosapentaenoic acid.

Term info

Label

cholesteryl (5Z,8Z,11Z,14Z,17Z-eicosapentaenoate)

Synonyms
  • cholesteryl (5Z,8Z,11Z,14Z,17Z-eicosapentaenoate)
database cross reference
Subsets

3_STAR

charge

0

formula

C47H74O2

has obo namespace

chebi_ontology

has related synonym

CE(20:5(5Z,8Z,11Z,14Z,17Z)), CE(20:5)

id

CHEBI:84969

inchi

InChI=1S/C47H74O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-45(48)49-40-32-34-46(5)39(36-40)28-29-41-43-31-30-42(38(4)26-24-25-37(2)3)47(43,6)35-33-44(41)46/h8-9,11-12,14-15,17-18,20-21,28,37-38,40-44H,7,10,13,16,19,22-27,29-36H2,1-6H3/b9-8-,12-11-,15-14-,18-17-,21-20-/t38-,40+,41+,42-,43+,44+,46+,47-/m1/s1

inchikey

XZFUGMCJZFRBKF-BDJFIEMMSA-N

mass

671.08930

monoisotopicmass

670.56888

smiles

CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C