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(Q104167560)
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English
7,9-dimethyl-5-(2-methylbut-3-en-2-yl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline
group of stereoisomers with the chemical formula C₂₁H₂₈N₂
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Statements
instance of
group of stereoisomers
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subclass of
ergoline alkaloid
1 reference
inferred from
ergoline alkaloid
mass
308.4612
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₈N₂
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canonical SMILES
C=CC(C=1NC2=CC=CC3=C2C1CC4N(C)CC(C)CC34)(C)C
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Identifiers
InChI
InChI=1S/C21H28N2/c1-6-21(3,4)20-16-11-18-15(10-13(2)12-23(18)5)14-8-7-9-17(22-20)19(14)16/h6-9,13,15,18,22H,1,10-12H2,2-5H3
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InChIKey
GXEMWNLJOIOIIM-UHFFFAOYSA-N
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PubChem CID
44715304
1 reference
based on heuristic
inferred from InChIKey
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