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CHEBI:166459 - MCOCH

Default Structure
ChEBI IDCHEBI:166459
ChEBI NameMCOCH
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SubmitterMetaboLights
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FormulaC17H28O6
Net Charge0
Average Mass328.405
Monoisotopic Mass328.18859
SMILESCC(CCCC(C)C(=O)O)COC(=O)C1CCCCC1C(=O)O
InChIInChI=1S/C17H28O6/c1-11(6-5-7-12(2)15(18)19)10-23-17(22)14-9-4-3-8-13(14)16(20)21/h11-14H,3-10H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyHHSQONIKWYBDMM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
MCOCH (CHEBI:166459) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
2-(6-carboxy-2-methylheptoxy)carbonylcyclohexane-1-carboxylic acid