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(Q105282758)
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English
(4,9,13-Trimethyl-18-methylidene-17-oxo-5,16-dioxatricyclo[13.3.0.04,6]octadeca-9,13-dien-3-yl) acetate
group of stereoisomers with the chemical formula C₂₂H₃₀O₅
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Statements
instance of
group of stereoisomers
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subclass of
cembrane
1 reference
inferred from
cembrane
mass
374.20932405999986
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₃₀O₅
0 references
canonical SMILES
O=C1OC2C=C(C)CCC=C(C)CCC3OC3(C)C(OC(=O)C)CC2C1=C
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Identifiers
InChI
InChI=1S/C22H30O5/c1-13-7-6-8-14(2)11-18-17(15(3)21(24)26-18)12-20(25-16(4)23)22(5)19(27-22)10-9-13/h7,11,17-20H,3,6,8-10,12H2,1-2,4-5H3
0 references
InChIKey
VAIRPKPEPRJXML-UHFFFAOYSA-N
0 references
PubChem CID
73198883
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VAIRPKPEPRJXML-UHFFFAOYSA-N
UniChem compound ID
69761179
1 reference
stated in
UniChem
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