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(Q104909269)
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English
[3-[5-(3-Chloro-5-formyl-2,6-dihydroxy-4-methylphenyl)-3-methylpenta-1,3-dienyl]-2,3,4-trimethyl-5-oxocyclohexyl] acetate
group of stereoisomers with the chemical formula C₂₅H₃₁ClO₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
462.180916392
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₃₁ClO₆
0 references
canonical SMILES
O=CC1=C(O)C(=C(O)C(Cl)=C1C)CC=C(C=CC2(C)C(C(=O)CC(OC(=O)C)C2C)C)C
0 references
Identifiers
InChI
InChI=1S/C25H31ClO6/c1-13(7-8-18-23(30)19(12-27)14(2)22(26)24(18)31)9-10-25(6)15(3)20(29)11-21(16(25)4)32-17(5)28/h7,9-10,12,15-16,21,30-31H,8,11H2,1-6H3
0 references
InChIKey
ACSLMZYXJATICN-UHFFFAOYSA-N
0 references
PubChem CID
75614472
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ACSLMZYXJATICN-UHFFFAOYSA-N
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