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CHEBI:206042 - (E)-9,10,12,13,15,16-hexahydroxyheptacos-18-enoic acid

ChEBI IDCHEBI:206042
ChEBI Name(E)-9,10,12,13,15,16-hexahydroxyheptacos-18-enoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H52O8
Net Charge0
Average Mass504.705
Monoisotopic Mass504.36622
SMILESCCCCCCCC/C=C/CC(O)C(O)CC(O)C(O)CC(O)C(O)CCCCCCCC(=O)O
InChIInChI=1S/C27H52O8/c1-2-3-4-5-6-7-8-10-13-16-21(28)23(30)19-25(32)26(33)20-24(31)22(29)17-14-11-9-12-15-18-27(34)35/h10,13,21-26,28-33H,2-9,11-12,14-20H2,1H3,(H,34,35)/b13-10+
InChIKeyZHEGLTRCODOIQP-JLHYYAGUSA-N
Species of MetaboliteComponentSourceComments
Dolichousnea longissima (ncbitaxon:281306) - PubMed (31216770)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(E)-9,10,12,13,15,16-hexahydroxyheptacos-18-enoic acid (CHEBI:206042) is a very long-chain fatty acid (CHEBI:27283)
IUPAC Name 
(E)-9,10,12,13,15,16-hexahydroxyheptacos-18-enoic acid