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quinine

Go to external page http://purl.obolibrary.org/obo/CHEBI_15854

A cinchona alkaloid that is cinchonidine in which the hydrogen at the 6-position of the quinoline ring is substituted by methoxy.

Term info

Label

quinine

Synonyms
  • (9R)-6'-methoxy-8alpha-cinchonan-9-ol
  • Quinine
  • quinine
database cross reference
Subsets

3_STAR

IUPAC NAME
(9R)-6'-methoxy-8alpha-cinchonan-9-ol [ IUPAC ]

charge

0

formula

C20H24N2O2

has alternative id

CHEBI:8723, CHEBI:569215, CHEBI:355947, CHEBI:26499, CHEBI:15001, CHEBI:127176, CHEBI:602929

has obo namespace

chebi_ontology

has related synonym

6'-methoxycinchonidine, Chinin, quinina, (R)-(6-methoxyquinolin-4-yl)((2S,4S,8R)-8-vinylquinuclidin-2-yl)methanol, (-)-Quinine, chinine, (R)-(-)-quinine, (8S,9R)-quinine, chininum, (-)-quinine

id

CHEBI:15854

inchi

InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19-,20+/m0/s1

inchikey

LOUPRKONTZGTKE-WZBLMQSHSA-N

mass

324.41680

monoisotopicmass

324.18378

smiles

[H][C@]1(C[C@@H]2CC[N@]1C[C@@H]2C=C)[C@H](O)c1ccnc2ccc(OC)cc12