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(Q104375791)
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English
Patchoulenone
group of stereoisomers with the chemical formula C₁₅H₂₂O
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Statements
instance of
group of stereoisomers
0 references
subclass of
cycloguaiane sesquiterpenoid
1 reference
inferred from
cycloguaiane sesquiterpenoid
mass
218.167065324
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₂O
0 references
canonical SMILES
O=C1C2=C(C)CCC23C(C)CCC1C3(C)C
0 references
found in taxon
Uvaria narum
1 reference
stated in
The Root Bark Essential Oil ofUvaria narumWall.
Cyperus rotundus
2 references
stated in
Antimalarial sesquiterpenes from tubers of Cyperus rotundus: structure of 10,12-peroxycalamenene, a sesquiterpene endoperoxide
stated in
On terpenes. CLXIV. Composition of the oil from Cyperus rotundus L. structure of patchoulenone
Identifiers
InChI
InChI=1S/C15H22O/c1-9-7-8-15-10(2)5-6-11(14(15,3)4)13(16)12(9)15/h10-11H,5-8H2,1-4H3
0 references
InChIKey
JAWSHISYWRRQQQ-UHFFFAOYSA-N
0 references
PubChem CID
5320424
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
JAWSHISYWRRQQQ-UHFFFAOYSA-N
UniChem compound ID
31997968
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0035747
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JAWSHISYWRRQQQ-UHFFFAOYSA-N
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