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CHEBI:57430 - (2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate

ChEBI IDCHEBI:57430
ChEBI Name(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate
Stars
ASCII Name(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate
DefinitionTricarboxylate anion of (2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid.
Last Modified13 November 2017
DownloadsMolfile
FormulaC16H25O7
Net Charge-3
Average Mass329.369
Monoisotopic Mass329.16167
SMILESCCCCCCCCCC[C@H](C(=O)[O-])[C@@](O)(CC(=O)[O-])C(=O)[O-]
InChIInChI=1S/C16H28O7/c1-2-3-4-5-6-7-8-9-10-12(14(19)20)16(23,15(21)22)11-13(17)18/h12,23H,2-11H2,1H3,(H,17,18)(H,19,20)(H,21,22)/p-3/t12-,16+/m1/s1
InChIKeyDQIHPEKINXOMBM-WBMJQRKESA-K
ChEBI Ontology
Outgoing Relation(s)
(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate (CHEBI:57430) is a tricarboxylic acid trianion (CHEBI:27092)
(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate (CHEBI:57430) is conjugate base of (2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid (CHEBI:15608)
Incoming Relation(s)
(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid (CHEBI:15608) is conjugate acid of (2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate (CHEBI:57430)
IUPAC Name 
(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate
Synonym  Source
(1S,2S)-1-decyl-2-hydroxypropane-1,2,3-tricarboxylateChEBI
UniProt Name  Source
(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylateUniProt