Cinchonan-9-ol, 6′-methoxy-, (8β,9R)-, mixt. with 2-hydroxy-1,2,3-propanetricarboxylic acid iron salt

CAS Registry Number®

8053-35-8

CAS Name

Cinchonan-9-ol, 6′-methoxy-, (8β,9R)-, mixt. with 2-hydroxy-1,2,3-propanetricarboxylic acid iron salt

Molecular Formula

C20H24N2O2.xC6H8O7.C6H8O7.xFe

Cite this Page

Cinchonan-9-ol, 6′-methoxy-, (8β,9R)-, mixt. with 2-hydroxy-1,2,3-propanetricarboxylic acid iron salt.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=8053-35-8 (retrieved 2024-12-23) (CAS RN: 8053-35-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H24N2O2.2C6H8O7.Fe/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;2*7-3(8)1-6(13,5(11)12)2-4(9)10;/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);/t13-,14-,19-,20+;;;/m0.../s1

InChIKey

InChIKey=WSKOILVGFPRYRZ-FLZPLBAKSA-N

SMILES

C(CC(O)=O)(CC(O)=O)(C(O)=O)O.[Fe].[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(CC(O)=O)(CC(O)=O)(C(O)=O)O

Canonical SMILES

[Fe].O=C(O)CC(O)(C(=O)O)CC(=O)O.O=C(O)CC(O)(C(=O)O)CC(=O)O.OC(C=1C=CN=C2C=CC(OC)=CC21)C3N4CCC(C3)C(C=C)C4

Other Names for this Substance

  • Cinchonan-9-ol, 6′-methoxy-, (8β,9R)-, mixt. with 2-hydroxy-1,2,3-propanetricarboxylic acid iron salt
  • Ferric quinine citrate green

CAS INSIGHTSTM
Pile of blue, green, and white color of capsule pills with modern design light.