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(Q105193019)
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English
16-(4-hydroxy-3,5-dimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-triene-10,14-dione
group of stereoisomers with the chemical formula C₂₁H₁₈O₈
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Statements
instance of
group of stereoisomers
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subclass of
arylnaphthalene-type lignan
1 reference
inferred from
arylnaphthalene-type lignan
mass
398.1001675359998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₁₈O₈
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canonical SMILES
O=C1OCC2C(=O)C3=CC=4OCOC4C=C3C(C5=CC(OC)=C(O)C(OC)=C5)C12
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Identifiers
InChI
InChI=1S/C21H18O8/c1-25-15-3-9(4-16(26-2)20(15)23)17-10-5-13-14(29-8-28-13)6-11(10)19(22)12-7-27-21(24)18(12)17/h3-6,12,17-18,23H,7-8H2,1-2H3
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InChIKey
OJDRVIHXHQXFSH-UHFFFAOYSA-N
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PubChem CID
13473529
1 reference
based on heuristic
inferred from InChIKey
UniChem compound ID
42630206
1 reference
stated in
UniChem
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