CHEBI:50579 - (S)-3-hydroxyoctadecanoic acid

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ChEBI Name (S)-3-hydroxyoctadecanoic acid
ChEBI ID CHEBI:50579
ChEBI ASCII Name (S)-3-hydroxyoctadecanoic acid
Definition A 3-hydroxyoctadecanoic acid in which the chiral centre has S configuration.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C18H36O3
Net Charge 0
Average Mass 300.477
Monoisotopic Mass 300.26645
InChI InChI=1S/C18H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(19)16-18(20)21/h17,19H,2-16H2,1H3,(H,20,21)/t17-/m0/s1
InChIKey POMQYTSPMKEQNB-KRWDZBQOSA-N
SMILES O=C(C[C@H](CCCCCCCCCCCCCCC)O)O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing (S)-3-hydroxyoctadecanoic acid (CHEBI:50579) is a 3-hydroxyoctadecanoic acid (CHEBI:50578)
(S)-3-hydroxyoctadecanoic acid (CHEBI:50579) is enantiomer of (R)-3-hydroxyoctadecanoic acid (CHEBI:145205)
Incoming (S)-3-hydroxyoctadecanoyl-CoA (CHEBI:50577) has functional parent (S)-3-hydroxyoctadecanoic acid (CHEBI:50579)
(R)-3-hydroxyoctadecanoic acid (CHEBI:145205) is enantiomer of (S)-3-hydroxyoctadecanoic acid (CHEBI:50579)
IUPAC Name
(3S)-3-hydroxyoctadecanoic acid
Synonyms Sources
(3S)-3-hydroxystearic acid ChEBI
(S)-3-hydroxystearic acid ChEBI
Manual Xref Database
LMFA01050434 LIPID MAPS
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Last Modified
08 March 2017