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CHEBI:79250 - (R,R)-3,17-dihydroxyoctadecanoic acid

ChEBI IDCHEBI:79250
ChEBI Name(R,R)-3,17-dihydroxyoctadecanoic acid
Stars
ASCII Name(R,R)-3,17-dihydroxyoctadecanoic acid
DefinitionAn (ω−1)-hydroxy fatty acid that is (17R)-17-hydroxyoctadecanoic acid ((17R)-17-hydroxystearic acid) in which the 3-pro-R hydrogen is replaced by a hydroxy group.
Last Modified23 March 2017
SubmitterGareth Owen
DownloadsMolfile
FormulaC18H36O4
Net Charge0
Average Mass316.482
Monoisotopic Mass316.26136
SMILESC[C@@H](O)CCCCCCCCCCCCC[C@@H](O)CC(=O)O
InChIInChI=1S/C18H36O4/c1-16(19)13-11-9-7-5-3-2-4-6-8-10-12-14-17(20)15-18(21)22/h16-17,19-20H,2-15H2,1H3,(H,21,22)/t16-,17-/m1/s1
InChIKeyRYSMTHYWWFCNKH-IAGOWNOFSA-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)
(R,R)-3,17-dihydroxyoctadecanoic acid (CHEBI:79250) has functional parent (R)-17-hydroxyoctadecanoic acid (CHEBI:79004)
(R,R)-3,17-dihydroxyoctadecanoic acid (CHEBI:79250) is a (ω−1)-hydroxy fatty acid (CHEBI:78954)
(R,R)-3,17-dihydroxyoctadecanoic acid (CHEBI:79250) is a 3-hydroxy carboxylic acid (CHEBI:61355)
(R,R)-3,17-dihydroxyoctadecanoic acid (CHEBI:79250) is a dihydroxy monocarboxylic acid (CHEBI:35972)
(R,R)-3,17-dihydroxyoctadecanoic acid (CHEBI:79250) is a hydroxyoctadecanoic acid (CHEBI:24747)
Incoming Relation(s)
bhas#32 (CHEBI:79236) has functional parent (R,R)-3,17-dihydroxyoctadecanoic acid (CHEBI:79250)
IUPAC Name 
(3R,17R)-3,17-dihydroxyoctadecanoic acid
Synonyms  Source
(R,R)-3,17-dihydroxystearic acidChEBI
(R,R)-3,17-dihydroxyoctadecanoic acidChEBI
(3R,17R)-3,17-dihydroxystearic acidChEBI