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Concept information

Preferred term

کینین (1+)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • +1

formula

  • C20H25N2O2

has_parent_hydride

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/p+1/t13-,14-,19-,20+/m0/s1

inchikey

  • LOUPRKONTZGTKE-WZBLMQSHSA-O

is_conjugate_acid_of

mass

  • 325.42470

monoisotopicmass

  • 325.19105

smiles

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

subset

  • 3_STAR

synonym EXACT

  • (9R)-9-hydroxy-6'-methoxy-8alpha-cinchonan-1-ium

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:137041

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