Cyclo(Glycyl-N~5~-Acetyl-N~5~-Hydroxy-L-Ornithyl-N~5~-Acetyl-N~5~-Hydroxy-L-Ornithyl-N~5~-Acetyl-N~5~-Hydroxy-L-Ornithylglycylglycyl)

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Properties Simple | Detailed

Formula C27H45N9O12
IUPAC Name n-[3-[(2s,5s,8s)-5,8-bis[3-[acetyl(hydroxy)amino]propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-n-hydroxy-acetamide
Molecular Mass 687.699 g·mol−1
Heat of Formation -1976.4 ± 16.7 kJ·mol−1
Dipole Moment 9.28 ± 1.08 D
Volume 836.02 Å 3
Surface Area 621.52 Å 2
HOMO Energy -9.72 ± 0.55 eV
LUMO Energy 0.42 ± eV
Point Group Symmetry C1
Synonyms
  • deferriferrichrome
  • ferrichrome, deferri-
  • n-[3-[(2s,5s,17s)-5,17-bis[3-(acetyl-hydroxy-amino)propyl]-3,6,9,12,15,18-hexaketo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-n-hydroxy-acetamide
  • n-[3-[(2s,5s,17s)-5,17-bis[3-(acetyl-hydroxy-amino)propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-n-hydroxy-acetamide
  • n-[3-[(2s,5s,17s)-5,17-bis[3-(acetyl-hydroxyamino)propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-n-hydroxyacetamide
  • n-[3-[(2s,5s,17s)-5,17-bis[3-(ethanoyl-hydroxy-amino)propyl]-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]propyl]-n-hydroxy-ethanamide
  • n-desferriferrichrome
  • n-dffc
CAS Number(s)
  • 34787-28-5
InChIKey ZFDAUYPBCXMSBF-ACRUOGEOSA-N
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