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(Q105344220)
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English
(8-acetyloxy-4,9-dihydroxy-8a-methyl-1-methylidene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-6-yl) 2-methylbut-2-enoate
group of stereoisomers with the chemical formula C₂₁H₂₈O₈
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
408.1784178559998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₈O₈
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canonical SMILES
O=C(OC1CC(OC(=O)C)C2(C)C(O)C3C(=C)C(=O)OC3C(O)CC12)C(=CC)C
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Identifiers
InChI
InChI=1S/C21H28O8/c1-6-9(2)19(25)28-14-8-15(27-11(4)22)21(5)12(14)7-13(23)17-16(18(21)24)10(3)20(26)29-17/h6,12-18,23-24H,3,7-8H2,1-2,4-5H3
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InChIKey
XXVFVBNBSVLKMY-UHFFFAOYSA-N
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PubChem CID
162973503
1 reference
based on heuristic
inferred from InChIKey
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