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(Q105148550)
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English
[5-(2,5,5,8a-tetramethyl-7-oxo-4,4a,6,8-tetrahydro-1H-naphthalen-1-yl)-3-methylpent-2-enyl] acetate
group of stereoisomers with the chemical formula C₂₂H₃₄O₃
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Statements
instance of
group of stereoisomers
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subclass of
labdanes
1 reference
inferred from
labdanes
mass
346.2507949479999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₃₄O₃
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canonical SMILES
O=C(OCC=C(C)CCC1C(=CCC2C(C)(C)CC(=O)CC12C)C)C
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Identifiers
InChI
InChI=1S/C22H34O3/c1-15(11-12-25-17(3)23)7-9-19-16(2)8-10-20-21(4,5)13-18(24)14-22(19,20)6/h8,11,19-20H,7,9-10,12-14H2,1-6H3
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InChIKey
LABJRCCKHONGEZ-UHFFFAOYSA-N
0 references
PubChem CID
162904075
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LABJRCCKHONGEZ-UHFFFAOYSA-N
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