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(Q105140966)
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English
4-Hydroxy-8-methyl-3,5,7-tris(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-1-(2-methylpropanoyl)bicyclo[3.3.1]non-3-ene-2,9-dione
group of stereoisomers with the chemical formula C₃₅H₅₂O₄
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
536.386560144
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₅H₅₂O₄
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canonical SMILES
O=C1C(=C(O)C2(C(=O)C1(C(=O)C(C)C)C(C)(CCC=C(C)C)C(CC=C(C)C)C2)CC=C(C)C)CC=C(C)C
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Identifiers
InChI
InChI=1S/C35H52O4/c1-22(2)13-12-19-33(11)27(16-14-23(3)4)21-34(20-18-25(7)8)30(37)28(17-15-24(5)6)31(38)35(33,32(34)39)29(36)26(9)10/h13-15,18,26-27,37H,12,16-17,19-21H2,1-11H3
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InChIKey
KGSZHKRKHXOAMG-UHFFFAOYSA-N
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PubChem CID
3662
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
28864205
1 reference
stated in
UniChem
Probes And Drugs ID
PD093931
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