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(Q105164529)
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English
[5-[5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enyl] acetate
group of stereoisomers with the chemical formula C₂₂H₃₆O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
labdanes
1 reference
inferred from
labdanes
mass
348.5203
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₆O₃
0 references
canonical SMILES
O=C(OCC=C(C)CCC1C(=C)CCC2C(C)(CO)CCCC12C)C
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Identifiers
InChI
InChI=1S/C22H36O3/c1-16(11-14-25-18(3)24)7-9-19-17(2)8-10-20-21(4,15-23)12-6-13-22(19,20)5/h11,19-20,23H,2,6-10,12-15H2,1,3-5H3
0 references
InChIKey
MIDQJBLRSOCEJR-UHFFFAOYSA-N
0 references
PubChem CID
163001237
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MIDQJBLRSOCEJR-UHFFFAOYSA-N
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