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

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 6alpha-Methyl-2alpha,6beta-dihydroxymethylbicyclo[3.1.1]heptane
ChEBI ID CHEBI:229027
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H18O2
Net Charge 0
Average Mass 170.252
Monoisotopic Mass 170.13068
InChI InChI=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
InChIKey GVQNYSGSGPTXSI-JVSARINNSA-N
SMILES OC[C@]1([C@]2(C[C@@]1(CCC2CO)[H])[H])C
Metabolite of Species Details
Zea mays (NCBI:txid4577) Found in exometabolome See: MetaboLights Study
ChEBI Ontology
Outgoing 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