Ferricrocin
[CAS# 23086-46-6]

Identification

• Name: Ferricrocin
• Synonyms: Ferric N-[3-[5,17-Bis[3-(Acetyl-Oxido-Amino)Propyl]-11-(Hydroxymethyl)-3,6,9,12,15,18-Hexaoxo-1,4,7,10,13,16-Hexazacyclooctadec-2-Yl]Propyl]-N-Oxido-Acetamide; Ferric N-[3-[5,17-Bis[3-(Acetyl-Oxidoamino)Propyl]-11-(Hydroxymethyl)-3,6,9,12,15,18-Hexaoxo-1,4,7,10,13,16-Hexazacyclooctadec-2-Yl]Propyl]-N-Oxidoacetamide; Ferric N-[3-[5,17-Bis[3-(Acetyl-Oxido-Amino)Propyl]-3,6,9,12,15,18-Hexaketo-11-Methylol-1,4,7,10,13,16-Hexazacyclooctadec-2-Yl]Propyl]-N-Oxido-Acetamide
• Molecular Formula: C₂₈H₄₄FeN₉O₁₃
• Molecular Weight: 770.56
• CAS Registry Number: 23086-46-6
• SMILES: C(C1NC(=O)C(NC(=O)CNC(=O)C(NC(=O)CNC(=O)C(NC1=O)CCCN([O-])C(=O)C)CO)CCCN([O-])C(=O)C)CCN([O-])C(=O)C.[Fe+3]
• InChI: 1S/C28H44N9O13.Fe/c1-16(39)35(48)10-4-7-19-25(44)29-14-24(43)32-22(15-38)26(45)30-13-23(42)31-20(8-5-11-36(49)17(2)40)27(46)34-21(28(47)33-19)9-6-12-37(50)18(3)41;/h19-22,38H,4-15H2,1-3H3,(H,29,44)(H,30,45)(H,31,42)(H,32,43)(H,33,47)(H,34,46);/q-3;+3
• InChIKey: FNBCUYMSQPYITB-UHFFFAOYSA-N