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CHEBI:229027 - 6alpha-Methyl-2alpha,6beta-dihydroxymethylbicyclo[3.1.1]heptane

ChEBI IDCHEBI:229027
ChEBI Name6alpha-Methyl-2alpha,6beta-dihydroxymethylbicyclo[3.1.1]heptane
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H18O2
Net Charge0
Average Mass170.252
Monoisotopic Mass170.13068
SMILES[H][C@]12CCC(CO)[C@]([H])(C1)[C@]2(C)CO
InChIInChI=1S/C10H18O2/c1-10(6-12)8-3-2-7(5-11)9(10)4-8/h7-9,11-12H,2-6H2,1H3/t7?,8-,9-,10+/m0/s1
InChIKeyGVQNYSGSGPTXSI-JVSARINNSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
6alpha-Methyl-2alpha,6beta-dihydroxymethylbicyclo[3.1.1]heptane (CHEBI:229027) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
[(1S,5S,6R)-6-(hydroxymethyl)-6-methyl-2-bicyclo[3.1.1]heptanyl]methanol