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(Q105102606)
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English
(8E)-4,9,12-trimethyl-3,14-dioxatricyclo[9.3.0.02,4]tetradec-8-en-13-one
group of stereoisomers with the chemical formula C₁₅H₂₂O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
250.156894564
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₂O₃
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canonical SMILES
O=C1OC2C3OC3(C)CCCC=C(C)CC2C1C
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isomeric SMILES
C/C1=C\CCCC2(C)OC2C2OC(=O)C(C)C2C1
1 reference
based on heuristic
inferred from InChI
found in taxon
Magnolia compressa
1 reference
stated in
Anticancer sesquiterpene lactones of Michelia compressa (magnoliaceae)
Identifiers
InChI
InChI=1S/C15H22O3/c1-9-6-4-5-7-15(3)13(18-15)12-11(8-9)10(2)14(16)17-12/h6,10-13H,4-5,7-8H2,1-3H3/b9-6+
0 references
InChIKey
CIGIQOGMEIBBRJ-RMKNXTFCSA-N
0 references
PubChem CID
5381212
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
58359834
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0302702
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CIGIQOGMEIBBRJ-RMKNXTFCSA-N
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