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(Q105148581)
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English
[8-Acetyloxy-10-hydroxy-3-(methoxymethyl)-6,10-dimethyl-2-oxo-4,5,8,9-tetrahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate
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
420.1784178559998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₂₈O₈
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canonical SMILES
O=C1OC2=CC(O)(C)CC(OC(=O)C)C=C(C)CC(OC(=O)C(=C)C)C2=C1COC
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Identifiers
InChI
InChI=1S/C22H28O8/c1-12(2)20(24)29-17-8-13(3)7-15(28-14(4)23)9-22(5,26)10-18-19(17)16(11-27-6)21(25)30-18/h7,10,15,17,26H,1,8-9,11H2,2-6H3
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InChIKey
LADIUQMLWWNQBC-UHFFFAOYSA-N
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PubChem CID
75151786
1 reference
based on heuristic
inferred from InChIKey
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