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(Q105172949)
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English
17-Methyl-17-(4-methylpent-3-enyl)-4,12,18-trioxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(21),5(10),6,8,13,19-hexaene-7,16,20-triol
group of stereoisomers with the chemical formula C₂₅H₂₈O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
2,6-dimethyloctane monoterpenoid
1 reference
inferred from
2,6-dimethyloctane monoterpenoid
mass
424.18858861599983
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₂₈O₆
0 references
canonical SMILES
OC1=CC=C2C(OCC3C4=CC(O)=C5OC(C)(CCC=C(C)C)C(O)CC5=C4OC23)=C1
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Identifiers
InChI
InChI=1S/C25H28O6/c1-13(2)5-4-8-25(3)21(28)11-17-23-16(10-19(27)24(17)31-25)18-12-29-20-9-14(26)6-7-15(20)22(18)30-23/h5-7,9-10,18,21-22,26-28H,4,8,11-12H2,1-3H3
0 references
InChIKey
MVDMPADXXDHNOL-UHFFFAOYSA-N
0 references
PubChem CID
101040109
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MVDMPADXXDHNOL-UHFFFAOYSA-N
UniChem compound ID
97135850
1 reference
stated in
UniChem
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