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CHEBI:202671 - CJ-13,982

Default Structure
ChEBI IDCHEBI:202671
ChEBI NameCJ-13,982
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O7
Net Charge0
Average Mass360.447
Monoisotopic Mass360.21480
SMILESCCCCCCCCCCCCC(C(=O)O)C(O)(CC(=O)O)C(=O)O
InChIInChI=1S/C18H32O7/c1-2-3-4-5-6-7-8-9-10-11-12-14(16(21)22)18(25,17(23)24)13-15(19)20/h14,25H,2-13H2,1H3,(H,19,20)(H,21,22)(H,23,24)
InChIKeyMPFLKMQGGVNBJS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
CJ-13,982 (CHEBI:202671) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
2-hydroxypentadecane-1,2,3-tricarboxylic acid
Manual XrefsDatabases
8604045ChemSpider