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(Q105034768)
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English
1-(Dimethylamino)-13-ethenyl-5-oxo-6-azatricyclo[7.3.1.02,7]trideca-2(7),3,10-triene-11-carboxylic acid
group of stereoisomers with the chemical formula C₁₇H₂₀N₂O₃
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Statements
instance of
group of stereoisomers
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subclass of
1-ethyl-2,4-dimethylcyclohexane monoterpenoids
1 reference
inferred from
1-ethyl-2,4-dimethylcyclohexane monoterpenoids
alkaloid
1 reference
inferred from
alkaloid
mass
300.14739249999997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₂₀N₂O₃
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canonical SMILES
O=C(O)C1=CC2CC3=NC(O)=CC=C3C(N(C)C)(C1)C2C=C
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Identifiers
InChI
InChI=1S/C17H20N2O3/c1-4-12-10-7-11(16(21)22)9-17(12,19(2)3)13-5-6-15(20)18-14(13)8-10/h4-7,10,12H,1,8-9H2,2-3H3,(H,18,20)(H,21,22)
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InChIKey
HWPHEPOWULNHKC-UHFFFAOYSA-N
0 references
PubChem CID
162969305
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HWPHEPOWULNHKC-UHFFFAOYSA-N
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