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(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol

HCID 5953
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Basic information

Standard SMILES
C=C[C@H]1CN2CCC1C[C@@H]2[C@@H](O)c1ccnc2ccc(OC)cc12
InChIKey
LOUPRKONTZGTKE-NBGVHYBESA-N
Molecular formula
C20H24N2O2
Average molar mass
324.4 g/mol

Overview

Quinaglute is a cinchona alkaloid.

Names & identifiers

Preferred name
(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
IUPAC
(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol

Names & synonyms

(S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanolSR-01000075163Quinidine (BAN)1234784-40-7Prestwick0_000280Prestwick1_000280Prestwick2_000280Lopac0_001009BSPBio_001467SPBio_002379SCHEMBL2760464SCHEMBL17664740
Show more names
GNF-PF-5459CHEBI:182417LOUPRKONTZGTKE-NBGVHYBESA-NHMS1989J09BDBM50410855EBC-06070C06527D08458

Database identifiers

PubChem CID
5953
ChEBI
CHEBI:182417

Properties

Computed structural propertiesFilling in

XLogP
2.9
Topological polar surface area
45.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
24
Formal charge
0
Complexity
457

Related reactions

31 records
New reaction record
HRID 46668 reaction equation
HRID 46668As productuspto-grants-1979_11
HRID 46807 reaction equation
HRID 46807As reactantuspto-grants-1979_11
HRID 424189 reaction equation
HRID 424189As reactantuspto-grants-2012_01
HRID 424202 reaction equation
HRID 424202As reactantuspto-grants-2012_01
HRID 447707 reaction equation
HRID 447707As reactantuspto-grants-2013_07
HRID 537750 reaction equation
HRID 537750As reactantuspto-grants-2014_10
HRID 548297 reaction equation
HRID 548297As reactantuspto-grants-2011_05
HRID 548310 reaction equation
HRID 548310As reactantuspto-grants-2011_05
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Compound notes

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