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CHEBI:79253 - (3R,20R)-3,20-dihydroxyhenicosanoic acid

ChEBI IDCHEBI:79253
ChEBI Name(3R,20R)-3,20-dihydroxyhenicosanoic acid
Stars
ASCII Name(3R,20R)-3,20-dihydroxyhenicosanoic acid
DefinitionAn (ω−1)-hydroxy fatty acid that is (20R)-20-hydroxyhenicosanoic acid in which the 3-pro-R hydrogen is replaced by a hydroxy group.
Last Modified17 July 2014
SubmitterGareth Owen
DownloadsMolfile
FormulaC21H42O4
Net Charge0
Average Mass358.563
Monoisotopic Mass358.30831
SMILESC[C@@H](O)CCCCCCCCCCCCCCCC[C@@H](O)CC(=O)O
InChIInChI=1S/C21H42O4/c1-19(22)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-20(23)18-21(24)25/h19-20,22-23H,2-18H2,1H3,(H,24,25)/t19-,20-/m1/s1
InChIKeySDVJFWYHVDNXTI-WOJBJXKFSA-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)
(3R,20R)-3,20-dihydroxyhenicosanoic acid (CHEBI:79253) has functional parent (20R)-20-hydroxyhenicosanoic acid (CHEBI:79017)
(3R,20R)-3,20-dihydroxyhenicosanoic acid (CHEBI:79253) is a (ω−1)-hydroxy fatty acid (CHEBI:78954)
(3R,20R)-3,20-dihydroxyhenicosanoic acid (CHEBI:79253) is a 3-hydroxy carboxylic acid (CHEBI:61355)
(3R,20R)-3,20-dihydroxyhenicosanoic acid (CHEBI:79253) is a dihydroxy monocarboxylic acid (CHEBI:35972)
(3R,20R)-3,20-dihydroxyhenicosanoic acid (CHEBI:79253) is a long-chain fatty acid (CHEBI:15904)
Incoming Relation(s)
bhas#38 (CHEBI:79239) has functional parent (3R,20R)-3,20-dihydroxyhenicosanoic acid (CHEBI:79253)
IUPAC Name 
(3R,20R)-3,20-dihydroxyhenicosanoic acid
Synonym  Source
(3R,20R)-3,20-dihydroxyheneicosanoic acidChEBI