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(Q104966021)
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English
(8-hydroxy-6-methyl-3,9-dimethylidene-2-oxo-4,6a,7,8,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl) 4-acetyloxy-2-methylbut-2-enoate
group of stereoisomers with the chemical formula C₂₂H₂₆O₇
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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
402.1678531719998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₂₆O₇
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canonical SMILES
O=C(OC1C=C(C)C2CC(O)C(=C)C2C3OC(=O)C(=C)C13)C(=CCOC(=O)C)C
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Identifiers
InChI
InChI=1S/C22H26O7/c1-10(6-7-27-14(5)23)21(25)28-17-8-11(2)15-9-16(24)12(3)18(15)20-19(17)13(4)22(26)29-20/h6,8,15-20,24H,3-4,7,9H2,1-2,5H3
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InChIKey
CNNITXXVNGOHOA-UHFFFAOYSA-N
0 references
PubChem CID
163032272
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CNNITXXVNGOHOA-UHFFFAOYSA-N
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