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CHEBI:183263 - 1,2-Cyclohexanedicarboxylic acid, 2-methylpent-3-yl nonyl ester

ChEBI IDCHEBI:183263
ChEBI Name1,2-Cyclohexanedicarboxylic acid, 2-methylpent-3-yl nonyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H42O4
Net Charge0
Average Mass382.585
Monoisotopic Mass382.30831
SMILESCCCCCCCCCOC(=O)C1CCCCC1C(=O)OC(CC)C(C)C
InChIInChI=1S/C23H42O4/c1-5-7-8-9-10-11-14-17-26-22(24)19-15-12-13-16-20(19)23(25)27-21(6-2)18(3)4/h18-21H,5-17H2,1-4H3
InChIKeyLQMSDKIOQPKZRS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS1866)
ChEBI Ontology
Outgoing Relation(s)
1,2-Cyclohexanedicarboxylic acid, 2-methylpent-3-yl nonyl ester (CHEBI:183263) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
2-O-(2-methylpentan-3-yl) 1-O-nonyl cyclohexane-1,2-dicarboxylate