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CHEBI:138082 - 9S,10S,11R-trihydroxy-12Z-octadecenoic acid

ChEBI IDCHEBI:138082
ChEBI Name9S,10S,11R-trihydroxy-12Z-octadecenoic acid
Stars
ASCII Name9S,10S,11R-trihydroxy-12Z-octadecenoic acid
Last Modified3 August 2017
Submittermwilliams
DownloadsMolfile
FormulaC18H34O5
Net Charge0
Average Mass330.465
Monoisotopic Mass330.24062
SMILESCCCCC/C=C\[C@@H](O)[C@@H](O)[C@@H](O)CCCCCCCC(=O)O
InChIInChI=1S/C18H34O5/c1-2-3-4-6-9-12-15(19)18(23)16(20)13-10-7-5-8-11-14-17(21)22/h9,12,15-16,18-20,23H,2-8,10-11,13-14H2,1H3,(H,21,22)/b12-9-/t15-,16+,18-/m1/s1
InChIKeyJHGVFGJXFVIYSM-BSHMHQBXSA-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)
9S,10S,11R-trihydroxy-12Z-octadecenoic acid (CHEBI:138082) is a long-chain fatty acid (CHEBI:15904)
Manual XrefsDatabases
LMFA02000011LIPID MAPS