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(Q104990366)
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English
methyl 5-[2-(furan-3-yl)-2-oxoethyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate
group of stereoisomers with the chemical formula C₂₁H₂₈O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
labdanes
1 reference
inferred from
labdanes
mass
344.1987593759999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₈O₄
0 references
canonical SMILES
O=C(OC)C1(C)CCCC2(C)C(C(=C)CCC12)CC(=O)C3=COC=C3
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Identifiers
InChI
InChI=1S/C21H28O4/c1-14-6-7-18-20(2,9-5-10-21(18,3)19(23)24-4)16(14)12-17(22)15-8-11-25-13-15/h8,11,13,16,18H,1,5-7,9-10,12H2,2-4H3
0 references
InChIKey
DVUUHZNLLSLOKO-UHFFFAOYSA-N
0 references
PubChem CID
85207099
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DVUUHZNLLSLOKO-UHFFFAOYSA-N
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