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(Q105325594)
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English
3,6,9-trimethylidene-2-oxo-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydroazuleno[4,5-b]furan-4-yl 2-ethyl-2-hydroxy-3-oxobutanoate
group of stereoisomers with the chemical formula C₂₇H₃₆O₁₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
guaiane sesquiterpenoid
1 reference
inferred from
guaiane sesquiterpenoid
mass
552.2206765919997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₇H₃₆O₁₂
0 references
canonical SMILES
O=C1OC2C(C1=C)C(OC(=O)C(O)(C(=O)C)CC)CC(=C)C3CC(OC4OC(CO)C(O)C(O)C4O)C(=C)C23
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Identifiers
InChI
InChI=1S/C27H36O12/c1-6-27(35,13(5)29)26(34)38-16-7-10(2)14-8-15(11(3)18(14)23-19(16)12(4)24(33)39-23)36-25-22(32)21(31)20(30)17(9-28)37-25/h14-23,25,28,30-32,35H,2-4,6-9H2,1,5H3
0 references
InChIKey
XDAZDQCYXFAYEX-UHFFFAOYSA-N
0 references
PubChem CID
162888616
1 reference
matched by identifier from
InChIKey
InChIKey
XDAZDQCYXFAYEX-UHFFFAOYSA-N
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