EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:191010 - 3-alahpda [dmed-fahfa]

ChEBI IDCHEBI:191010
ChEBI Name3-alahpda [dmed-fahfa]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H58O4
Net Charge0
Average Mass518.823
Monoisotopic Mass518.43351
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC(CCCCCCCCCCCC)CC(=O)O
InChIInChI=1S/C33H58O4/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-33(36)37-31(30-32(34)35)28-26-24-22-20-14-12-10-8-6-4-2/h5,7,11,13,16-17,31H,3-4,6,8-10,12,14-15,18-30H2,1-2H3,(H,34,35)/b7-5-,13-11-,17-16-
InChIKeyLHQQEQNFQUNBEN-YYPVPKODSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) INS-1 cell (BTO:0002135) MetaboLights (MTBLS3963)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-alahpda [dmed-fahfa] (CHEBI:191010) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypentadecanoic acid