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(Q105207088)
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English
(5,8-Diacetyloxy-7-benzoyloxy-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-12-yl) 1-methyl-6-oxopyridine-3-carboxylate
group of stereoisomers with the chemical formula C₃₃H₃₉NO₁₁
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Statements
instance of
group of stereoisomers
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subclass of
eudesmane sesquiterpenoid
1 reference
inferred from
eudesmane sesquiterpenoid
alkaloid
1 reference
inferred from
alkaloid
mass
625.6641
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₃H₃₉NO₁₁
0 references
canonical SMILES
O=C(OC1C(OC(=O)C)C2C(OC(=O)C=3C=CC(=O)N(C3)C)C4(OC2(C)C)C(O)(C)CCC(OC(=O)C)C14C)C=5C=CC=CC5
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Identifiers
InChI
InChI=1S/C33H39NO11/c1-18(35)41-22-15-16-31(5,40)33-26(43-29(39)21-13-14-23(37)34(7)17-21)24(30(3,4)45-33)25(42-19(2)36)27(32(22,33)6)44-28(38)20-11-9-8-10-12-20/h8-14,17,22,24-27,40H,15-16H2,1-7H3
0 references
InChIKey
PEFXNCJFEYSZKT-UHFFFAOYSA-N
0 references
PubChem CID
73090926
1 reference
based on heuristic
inferred from InChIKey
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