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CHEBI:186863 - (+)-Dysideapalaunic acid

ChEBI IDCHEBI:186863
ChEBI Name(+)-Dysideapalaunic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H40O2
Net Charge0
Average Mass372.593
Monoisotopic Mass372.30283
SMILESCC(C)=CCC[C@]1(C)CCC[C@]2(C)C(CC/C(C)=C/C(=O)O)=C(C)CCC12
InChIInChI=1S/C25H40O2/c1-18(2)9-7-14-24(5)15-8-16-25(6)21(20(4)11-13-22(24)25)12-10-19(3)17-23(26)27/h9,17,22H,7-8,10-16H2,1-6H3,(H,26,27)/b19-17+/t22?,24-,25-/m1/s1
InChIKeyVMXBEUNFNFIWLY-HKAUEAINSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
(+)-Dysideapalaunic acid (CHEBI:186863) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
(E)-5-[(5S,8aS)-2,5,8a-trimethyl-5-(4-methylpent-3-enyl)-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid
Manual XrefsDatabases
24846834ChemSpider