DEF

DEFEROXAMINE MESYLATE FE(III) COMPLEX

Created:2001-10-16
Last modified:  2023-09-23

Help

Find related ligands:

Chemical Details

Formal Charge0
Atom Count95
Chiral Atom Count2
Bond Count99
Aromatic Bond Count0
2D diagram of DEF

WebGL does not seem to be available.

This can be caused by an outdated browser, graphics card driver issue, or bad weather. Sometimes, just restarting the browser helps. Also, make sure hardware acceleration is enabled in your browser.

For a list of supported browsers, refer to http://caniuse.com/#feat=webgl.

Toggle HydrogenToggle Labels

Chemical Component Summary

NameDEFEROXAMINE MESYLATE FE(III) COMPLEX
FormulaC27 H49 Fe N6 O11 S
Molecular Weight721.622
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385CCC(=O)[N]1CCCCCNC(=O)CCC(=O)[N]2CCCCCNC(=O)CCC(=O)N(CCCCCNO[S](C)(=O)=O)O[Fe](O1)O2
SMILESOpenEye OEToolkits2.0.7CCC1=O[Fe]2345O=C(CCC(=O)NCCCCCN1O2)N(O3)CCCCCNC(=O)CCC(=O4)N(O5)CCCCCNOS(=O)(=O)C
Canonical SMILESCACTVS3.385 CCC(=O)[N@]1CCCCCNC(=O)CCC(=O)[N@]2CCCCCNC(=O)CCC(=O)N(CCCCCNO[S](C)(=O)=O)O[Fe](O1)O2
Canonical SMILESOpenEye OEToolkits2.0.7 CCC1=O[Fe]2345O=C(CCC(=O)NCCCCCN1O2)N(O3)CCCCCNC(=O)CCC(=O4)N(O5)CCCCCNOS(=O)(=O)C
InChIInChI1.06 InChI=1S/C27H49N6O11S.Fe/c1-3-25(36)31(39)20-10-4-7-17-28-23(34)13-15-26(37)32(40)21-11-5-8-18-29-24(35)14-16-27(38)33(41)22-12-6-9-19-30-44-45(2,42)43;/h30H,3-22H2,1-2H3,(H,28,34)(H,29,35);/q-3;+3
InChIKeyInChI1.06 UZNCKXZKODNQDS-UHFFFAOYSA-N