EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:77538 - (21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid

ChEBI IDCHEBI:77538
ChEBI Name(21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid
Stars
ASCII Name(21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid
DefinitionAn ω−6 fatty acid that is hexatriacontanoic acid having four double bonds located at positions 21, 24, 27 and 30 (the 21Z,24Z,27Z,30Z-isomer).
Last Modified30 January 2019
SubmitterSteve
DownloadsMolfile
FormulaC36H64O2
Net Charge0
Average Mass528.906
Monoisotopic Mass528.49063
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)O
InChIInChI=1S/C36H64O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36(37)38/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-35H2,1H3,(H,37,38)/b7-6-,10-9-,13-12-,16-15-
InChIKeyPEMVOZOAPAFWKW-DOFZRALJSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid (CHEBI:77538) is a hexatriacontatetraenoic acid (CHEBI:78935)
(21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid (CHEBI:77538) is a ultra-long-chain fatty acid (CHEBI:143004)
(21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid (CHEBI:77538) is a ω−6 fatty acid (CHEBI:36009)
(21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid (CHEBI:77538) is conjugate acid of (21Z,24Z,27Z,30Z)-hexatriacontatetraenoate (CHEBI:77235)
Incoming Relation(s)
(21Z,24Z,27Z,30Z)-3-oxohexatriacontatetraenoyl-CoA (CHEBI:74522) has functional parent (21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid (CHEBI:77538)
(21Z,24Z,27Z,30Z)-hexatriacontatetraenoate (CHEBI:77235) is conjugate base of (21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid (CHEBI:77538)
IUPAC Name 
(21Z,24Z,27Z,30Z)-hexatriaconta-21,24,27,30-tetraenoic acid
Synonyms  Source
all-cis-hexatriaconta-21,24,27,30-tetraenoic acidChEBI
36:4(21Z,24Z,27Z,30Z)ChEBI
21Z,24Z,27Z,30Z-hexatriacontatetraenoic acidChEBI
36:4(ω6)LIPID MAPS
36:4n6ChEBI
Manual XrefsDatabases
LMFA01030829LIPID MAPS