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CHEBI:227672 - Myrrhlalkyldiol

ChEBI IDCHEBI:227672
ChEBI NameMyrrhlalkyldiol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O2
Net Charge0
Average Mass238.371
Monoisotopic Mass238.19328
SMILESCC1=CC=C(C(C)CCC(O)C(C)(C)O)CC1
InChIInChI=1S/C15H26O2/c1-11-5-8-13(9-6-11)12(2)7-10-14(16)15(3,4)17/h5,8,12,14,16-17H,6-7,9-10H2,1-4H3
InChIKeyJBTWEBDTSZPNTF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Boreostereum vibrans (ncbitaxon:1826779) - PubMed (23909294)
ChEBI Ontology
Outgoing Relation(s)
Myrrhlalkyldiol (CHEBI:227672) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
2-methyl-6-(4-methylcyclohexa-1,3-dien-1-yl)heptane-2,3-diol
Manual XrefsDatabases
78435735ChemSpider