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CHEBI:15615 - (3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid

ChEBI IDCHEBI:15615
ChEBI Name(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid
Stars
ASCII Name(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid
Secondary ChEBI IDsCHEBI:219, CHEBI:10893
Last Modified18 August 2008
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC17H30O7
Net Charge0
Average Mass346.420
Monoisotopic Mass346.19915
SMILESCCCCCCCCCC[C@H](C(=O)O)[C@@](O)(CCC(=O)O)C(=O)O
InChIInChI=1S/C17H30O7/c1-2-3-4-5-6-7-8-9-10-13(15(20)21)17(24,16(22)23)12-11-14(18)19/h13,24H,2-12H2,1H3,(H,18,19)(H,20,21)(H,22,23)/t13-,17+/m1/s1
InChIKeyQFOFNCNFUGQWTO-DYVFJYSZSA-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)
(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid (CHEBI:15615) has functional parent pentadecanoic acid (CHEBI:42504)
(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid (CHEBI:15615) is a tricarboxylic acid (CHEBI:27093)
(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid (CHEBI:15615) is conjugate acid of (3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylate (CHEBI:57435)
Incoming Relation(s)
(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylate (CHEBI:57435) is conjugate base of (3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid (CHEBI:15615)
IUPAC Name 
(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid
Synonym  Source
(3S,4S)-3-Hydroxytetradecane-1,3,4-tricarboxylateKEGG COMPOUND
Manual XrefsDatabases
C04529KEGG COMPOUND