(3α,8α,9S)-6'-Methoxycinchonan-9-ol sulfate hydrate (2:1:2)

More details:

• Systematic name

  (3alpha,8alpha,9S)-6'-Methoxycinchonan-9-ol sulfate hydrate (2:1:2)

• SMILES

  O.O.COC1=CC2=C(C=CN=C2C=C1)[C@H](O)[C@@H]1C[C@@H]2CCN1C[C@@H]2C=C.COC1=CC2=C(C=CN=C2C=C1)[C@H](O)[C@@H]1C[C@@H]2CCN1C[C@@H]2C=C.OS(O)(=O)=O

• Std. InChi

  InChI=1S/2C20H24N2O2.H2O4S.2H2O/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;1-5(2,3)4;;/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4);2*1H2/t2*13-,14-,19-,20-;;;/m00.../s1

• Std. InChIKey

  ZHNFLHYOFXQIOW-CMZPEELOSA-N

• Cite this record

  CSID:78430412, http://www.chemspider.com/Chemical-Structure.78430412.html (accessed 01:40, May 17, 2024)