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CHEBI:29743 - 3-oxododecanoate

ChEBI IDCHEBI:29743
ChEBI Name3-oxododecanoate
Stars
Secondary ChEBI IDsCHEBI:11873, CHEBI:20167
Last Modified6 February 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC12H21O3
Net Charge-1
Average Mass213.297
Monoisotopic Mass213.14962
SMILESCCCCCCCCCC(=O)CC(=O)[O-]
InChIInChI=1S/C12H22O3/c1-2-3-4-5-6-7-8-9-11(13)10-12(14)15/h2-10H2,1H3,(H,14,15)/p-1
InChIKeyDZHSPYMHDVROSM-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
3-oxododecanoate (CHEBI:29743) has functional parent dodecanoate (CHEBI:18262)
3-oxododecanoate (CHEBI:29743) is a 3-oxo fatty acid anion (CHEBI:133292)
3-oxododecanoate (CHEBI:29743) is conjugate base of 3-oxolauric acid (CHEBI:18037)
Incoming Relation(s)
3-oxolauric acid (CHEBI:18037) is conjugate acid of 3-oxododecanoate (CHEBI:29743)
IUPAC Name 
3-oxododecanoate
Synonym  Source
3-OxododecanoateKEGG COMPOUND
UniProt Name  Source
3-oxododecanoateUniProt
Manual XrefsDatabases
C02367KEGG COMPOUND