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

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ChEBI Name (3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid
ChEBI ID CHEBI:15615
ChEBI ASCII Name (3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:10893, CHEBI:219
Supplier Information
Download Molfile XML SDF
Formula C17H30O7
Net Charge 0
Average Mass 346.41590
Monoisotopic Mass 346.199
InChI InChI=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
InChIKey QFOFNCNFUGQWTO-DYVFJYSZSA-N
SMILES CCCCCCCCCC[C@H](C(O)=O)[C@@](O)(CCC(O)=O)C(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 (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 (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-tricarboxylate KEGG COMPOUND
Database Link Database
C04529 KEGG COMPOUND
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Last Modified
18 August 2008