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Substance Name: Quinine glycerophosphate [NF]
RN: 146-39-4
UNII: 9212688A9J
InChIKey: YZDDKALBXAGVHK-VMJVVOMYSA-N

Molecular Formula

  • C20-H24-N2-O2.1/2C3-H9-O6-P

Molecular Weight

  • 820.9153
 
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Names and Synonyms

Name of Substance

  • Quinine glycerophosphate
  • Quinine glycerophosphate [NF]

Synonyms

  • CCRIS 5760
  • EINECS 205-669-4
  • Quinine glycerophosphate
  • UNII-9212688A9J

Systematic Names

  • (8alpha,9R)-6'-Methoxycinchonan-9-ol, compound with 2,3-dihydroxypropyl (dihydrogen phosphate) (2:1)
  • Quinine glycerophosphate

Registry Numbers

CAS Registry Number

  • 146-39-4

FDA UNII

  • 9212688A9J

System Generated Number

  • 0000146394

Molecular Formulas

Molecular Formula

  • C20-H24-N2-O2.1/2C3-H9-O6-P

Molecular Formula Fragments

  • C20-H24-N2-O2
  • C3-H9-O6-P
  • COMPONENT

Structure Descriptors

InChI

1S/2C20H24N2O2.C3H9O6P/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;4-1-3(5)2-9-10(6,7)8/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;3-5H,1-2H2,(H2,6,7,8)/t2*13-,14-,19-,20+;/m00./s1

InChIKey

YZDDKALBXAGVHK-VMJVVOMYSA-N

Smiles

COc1ccc2nccc([C@@H](O)[C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1.COc5ccc6nccc([C@@H](O)[C@@H]7C[C@@H]8CCN7C[C@@H]8C=C)c6c5.OCC(O)COP(=O)(O)O