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(Q105158908)
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English
(5,7-dihydroxy-9-methyl-3,6-dimethylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl) 2-(acetyloxymethyl)but-2-enoate
group of stereoisomers with the chemical formula C₂₂H₂₆O₈
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Statements
instance of
group of stereoisomers
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subclass of
guaiane sesquiterpenoid
1 reference
inferred from
guaiane sesquiterpenoid
mass
418.1627677919998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₂₆O₈
0 references
canonical SMILES
O=C1OC2C(C1=C)C(OC(=O)C(=CC)COC(=O)C)C(O)C(=C)C3C(O)C=C(C)C23
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Identifiers
InChI
InChI=1S/C22H26O8/c1-6-13(8-28-12(5)23)22(27)30-20-17-11(4)21(26)29-19(17)15-9(2)7-14(24)16(15)10(3)18(20)25/h6-7,14-20,24-25H,3-4,8H2,1-2,5H3
0 references
InChIKey
LXKUVYQBYVNGFE-UHFFFAOYSA-N
0 references
PubChem CID
162884955
1 reference
based on heuristic
inferred from InChIKey
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