Quinine glycerophosphate

CAS Registry Number®

146-39-4

CAS Name

Quinine glycerophosphate

Molecular Formula

C20H24N2O2.1/2C3H9O6P

Cite this Page

Quinine glycerophosphate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=146-39-4 (retrieved 2024-11-26) (CAS RN: 146-39-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H24N2O2.C3H9O6P/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;4-1-3(5)2-9-10(6,7)8/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;3-5H,1-2H2,(H2,6,7,8)/t13-,14-,19-,20+;/m0./s1

InChIKey

InChIKey=ZCLWGJJWKJYQIM-DSXUQNDKSA-N

SMILES

[C@@H](O)(C=1C2=C(C=CC(OC)=C2)N=CC1)[C@]3([N@@]4C[C@H](C=C)[C@](C3)(CC4)[H])[H].C(C(CO)O)OP(=O)(O)O

Canonical SMILES

O=P(O)(O)OCC(O)CO.OC(C=1C=CN=C2C=CC(OC)=CC21)C3N4CCC(C3)C(C=C)C4

Other Names for this Substance

  • Cinchonan-9-ol, 6′-methoxy-, (8α,9R)-, compd. with 2,3-dihydroxypropyl dihydrogen phosphate (2:1)
  • Quinine, compd. with 1-glycerophosphoric acid (2:1)
  • 1,2,3-Propanetriol, 1-(dihydrogen phosphate), compd. with (8α,9R)-6′-methoxycinchonan-9-ol (1:2)
  • Kineurine
  • Quinine glycerophosphate

CAS INSIGHTSTM
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