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CHEBI:230643 - Lepidiumterpenoid

ChEBI IDCHEBI:230643
ChEBI NameLepidiumterpenoid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H48O2
Net Charge0
Average Mass404.679
Monoisotopic Mass404.36543
SMILESCCCC(C)CCCC(C)C(=O)CC(O)C(C)C/C=C/C1=C(C)CCCC1(C)C
InChIInChI=1S/C27H48O2/c1-8-12-20(2)13-9-14-22(4)25(28)19-26(29)23(5)15-10-17-24-21(3)16-11-18-27(24,6)7/h10,17,20,22-23,26,29H,8-9,11-16,18-19H2,1-7H3/b17-10+
InChIKeyJSSNFOHEHRIBDT-LICLKQGHSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
Lepidiumterpenoid (CHEBI:230643) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(E)-5-hydroxy-4,8,12-trimethyl-1-(2,6,6-trimethylcyclohexen-1-yl)pentadec-1-en-7-one
Manual XrefsDatabases
HMDB0036844HMDB
8844324ChemSpider