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(Q104937437)
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English
[12-(Acetyloxymethyl)-8-formyl-4-methyl-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradeca-7,11-dien-10-yl] 3-methylbutanoate
group of stereoisomers with the chemical formula C₂₂H₂₈O₈
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Statements
instance of
group of stereoisomers
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subclass of
germacrane sesquiterpenoid
1 reference
inferred from
germacrane sesquiterpenoid
mass
420.4538
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₈O₈
0 references
canonical SMILES
O=CC1=CCCC2(OC2C3OC(=O)C(=C3C(OC(=O)CC(C)C)C1)COC(=O)C)C
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found in taxon
Vernonia galamensis
1 reference
stated in
A glaucolide-type sesquiterpene lactone from Vernonia galamensis ssp. nairobensis
Identifiers
InChI
InChI=1S/C22H28O8/c1-12(2)8-17(25)28-16-9-14(10-23)6-5-7-22(4)20(30-22)19-18(16)15(21(26)29-19)11-27-13(3)24/h6,10,12,16,19-20H,5,7-9,11H2,1-4H3
0 references
InChIKey
BJXNZMRTVPTJJY-UHFFFAOYSA-N
0 references
PubChem CID
163014089
1 reference
based on heuristic
inferred from InChIKey
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