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CHEBI:190816 - Tetranor-PGAM

ChEBI IDCHEBI:190816
ChEBI NameTetranor-PGAM
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22O6
Net Charge0
Average Mass310.346
Monoisotopic Mass310.14164
SMILESO=C(O)CCCCC(=O)CC[C@H]1C=CC(=O)[C@@H]1CCC(=O)O
InChIInChI=1S/C16H22O6/c17-12(3-1-2-4-15(19)20)7-5-11-6-9-14(18)13(11)8-10-16(21)22/h6,9,11,13H,1-5,7-8,10H2,(H,19,20)(H,21,22)/t11-,13+/m0/s1
InChIKeyHYPIFMOQVFWSBF-WCQYABFASA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) root (BTO:0001188) MetaboLights (MTBLS4362)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Tetranor-PGAM (CHEBI:190816) is a oxo carboxylic acid (CHEBI:25754)
IUPAC Name 
8-[(1S,5R)-5-(2-carboxyethyl)-4-oxocyclopent-2-en-1-yl]-6-oxooctanoic acid
Manual XrefsDatabases
29341885ChemSpider