Ferrioxamine E

CAS Registry Number®

20008-20-2
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CAS Name

Ferrioxamine E

Molecular Formula

C27H45FeN6O9

Cite this Page

Ferrioxamine E.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=20008-20-2 (retrieved 2024-04-29) (CAS RN: 20008-20-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H45N6O9.Fe/c34-22-10-14-26(38)32(41)20-8-3-6-18-30-24(36)12-15-27(39)33(42)21-9-2-5-17-29-23(35)11-13-25(37)31(40)19-7-1-4-16-28-22;/h1-21H2,(H,28,34)(H,29,35)(H,30,36);/q-3;+3

InChIKey

InChIKey=MZFKJKOHYACYNT-UHFFFAOYSA-N

SMILES

O=C1CCC2=O[Fe+3]3456O=C(N([O-]3)CCCCCN1)CCC(=O)NCCCCCN([O-]4)C(=O5)CCC(=O)NCCCCCN2[O-]6

Canonical SMILES

O=C1NCCCCCN2[O-][Fe+3]3456O=C(N([O-]3)CCCCCNC(=O)CCC(=O4)N([O-]5)CCCCCNC(=O)CCC2=O6)CC1

Other Names for this Substance

  • Iron, [1,12,23-tri(hydroxy-κO)-1,6,12,17,23,28-hexaazacyclotritriacontane-2,5,13,16,24,27-hexonato(3-)-κO2O13O24]-, (OC-6-22)-
  • Iron, [1,12,23-trihydroxy-1,6,12,17,23,28-hexaazacyclotritriacontane-2,5,13,16,24,27-hexonato(3-)]-
  • Iron, [1,12,23-trihydroxy-1,6,12,17,23,28-hexaazacyclotritriacontane-2,5,13,16,24,27-hexonato(3-)-O1,O2,O12,O13,O23,O24]-, (OC-6-22)-
  • 1,6,12,17,23,28-Hexaazacyclotritriacontane-2,5,13,16,24,27-hexone, 1,12,23-trihydroxy-, iron complex
  • 1,6,12,17,23,28-Hexaazacyclotritriacontane, iron deriv.

Deleted or Replaced CAS Registry Numbers

12574-36-6, 28993-30-8

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