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Substance Name: Quinine citrate
RN: 752-72-7
UNII: L8D5LFU229
InChIKey: YSFIPRFOHJQXJF-VMJVVOMYSA-N

Molecular Formula

  • C20-H24-N2-O2.1/2C6-H8-O7

Molecular Weight

  • 840.9654
 
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Names and Synonyms

Results Name

  • Quinine citrate

Name of Substance

  • Quinine citrate

Synonyms

  • EINECS 212-037-1
  • Quinine citrate
  • UNII-L8D5LFU229

Systematic Name

  • (8alpha,9R)-6'-Methoxycinchonan-9-ol, salt with citric acid (2:1)

Registry Numbers

CAS Registry Number

  • 752-72-7

FDA UNII

  • L8D5LFU229

System Generated Number

  • 0000752727

Molecular Formulas

Molecular Formula

  • C20-H24-N2-O2.1/2C6-H8-O7

Molecular Formula Fragments

  • C20-H24-N2-O2
  • C6-H8-O7
  • COMPONENT

Structure Descriptors

InChI

1S/2C20H24N2O2.C6H8O7/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;7-3(8)1-6(13,5(11)12)2-4(9)10/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t2*13-,14-,19-,20+;/m00./s1

InChIKey

YSFIPRFOHJQXJF-VMJVVOMYSA-N

Smiles

COc1ccc2c(c1)c(ccn2)[C@H]([C@@H]3C[C@@H]4CC[N@]3C[C@@H]4C=C)O.COc1ccc2c(c1)c(ccn2)[C@H]([C@@H]3C[C@@H]4CC[N@]3C[C@@H]4C=C)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O