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(Q105344633)
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English
3-[2-[1,4-Dimethyl-2-(1,4,5-trihydroxy-9-oxoxanthen-3-yl)cyclohex-3-en-1-yl]ethenyl]-1,4,5-trihydroxyxanthen-9-one
group of stereoisomers with the chemical formula C₃₆H₂₈O₁₀
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Statements
instance of
group of stereoisomers
0 references
subclass of
1-ethyl-1,4-dimethylcyclohexane monoterpenoids
1 reference
inferred from
1-ethyl-1,4-dimethylcyclohexane monoterpenoids
biogenic xanthone
1 reference
inferred from
biogenic xanthone
mass
620.168247096
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₆H₂₈O₁₀
0 references
canonical SMILES
O=C1C=2C=CC=C(O)C2OC3=C(O)C(C=CC4(C)CCC(=CC4C5=CC(O)=C6C(=O)C=7C=CC=C(O)C7OC6=C5O)C)=CC(O)=C13
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Identifiers
InChI
InChI=1S/C36H28O10/c1-16-9-11-36(2,12-10-17-14-24(39)26-29(42)18-5-3-7-22(37)32(18)45-34(26)28(17)41)21(13-16)20-15-25(40)27-30(43)19-6-4-8-23(38)33(19)46-35(27)31(20)44/h3-8,10,12-15,21,37-41,44H,9,11H2,1-2H3
0 references
InChIKey
XYRCPMXSIHHGSO-UHFFFAOYSA-N
0 references
PubChem CID
85098057
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XYRCPMXSIHHGSO-UHFFFAOYSA-N
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