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(Q104998028)
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English
12-(acetyloxy)-4,5,7-tris(benzoyloxy)-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-8-yl pyridine-3-carboxylate
group of stereoisomers with the chemical formula C₄₄H₄₃NO₁₁
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Statements
instance of
group of stereoisomers
0 references
subclass of
eudesmane sesquiterpenoid
1 reference
inferred from
eudesmane sesquiterpenoid
pyridine alkaloids
1 reference
inferred from
pyridine alkaloids
mass
761.2836111960003
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₄₄H₄₃NO₁₁
0 references
canonical SMILES
O=C(OC1CC(C)C23OC(C)(C)C(C(OC(=O)C=4C=NC=CC4)C(OC(=O)C=5C=CC=CC5)C2(C)C1OC(=O)C=6C=CC=CC6)C3OC(=O)C)C=7C=CC=CC7
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Identifiers
InChI
InChI=1S/C44H43NO11/c1-26-24-32(52-38(47)28-16-9-6-10-17-28)35(54-39(48)29-18-11-7-12-19-29)43(5)37(55-40(49)30-20-13-8-14-21-30)34(53-41(50)31-22-15-23-45-25-31)33-36(51-27(2)46)44(26,43)56-42(33,3)4/h6-23,25-26,32-37H,24H2,1-5H3
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InChIKey
FMSHZBLGSXKBSB-UHFFFAOYSA-N
0 references
PubChem CID
14828961
1 reference
based on heuristic
inferred from InChIKey
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