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CHEBI:79001 - (16R)-16-hydroxymargaric acid

Default Structure
ChEBI IDCHEBI:79001
ChEBI Name(16R)-16-hydroxymargaric acid
Stars
ASCII Name(16R)-16-hydroxymargaric acid
DefinitionAn (ω−1)-hydroxy fatty acid that is heptadecanoic acid in which the 16-pro-R hydrogen is replaced by a hydroxy group.
Last Modified17 July 2014
SubmitterGareth Owen
DownloadsMolfile
FormulaC17H34O3
Net Charge0
Average Mass286.456
Monoisotopic Mass286.25079
SMILESC[C@@H](O)CCCCCCCCCCCCCCC(=O)O
InChIInChI=1S/C17H34O3/c1-16(18)14-12-10-8-6-4-2-3-5-7-9-11-13-15-17(19)20/h16,18H,2-15H2,1H3,(H,19,20)/t16-/m1/s1
InChIKeyZZTJPRCYRMWKTD-MRXNPFEDSA-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)
(16R)-16-hydroxymargaric acid (CHEBI:79001) has functional parent heptadecanoic acid (CHEBI:32365)
(16R)-16-hydroxymargaric acid (CHEBI:79001) is a (ω−1)-hydroxy fatty acid (CHEBI:78954)
(16R)-16-hydroxymargaric acid (CHEBI:79001) is a long-chain fatty acid (CHEBI:15904)
Incoming Relation(s)
(3R,16R)-3,16-dihydroxymargaric acid (CHEBI:79249) has functional parent (16R)-16-hydroxymargaric acid (CHEBI:79001)
ascr#30 (CHEBI:78968) has functional parent (16R)-16-hydroxymargaric acid (CHEBI:79001)
IUPAC Name 
(16R)-16-hydroxyheptadecanoic acid
Synonyms  Source
(R)-16-hydroxyheptadecanoic acidChEBI
(R)-16-hydroxymargaric acidChEBI