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
[CAS# 34787-28-5]

Identification

• Name: 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
• Synonyms: 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-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-(Ethanoyl-Hydroxy-Amino)Propyl]-3,6,9,12,15,18-Hexaoxo-1,4,7,10,13,16-Hexazacyclooctadec-2-Yl]Propyl]-N-Hydroxy-Ethanamide
• Molecular Formula: C₂₇H₄₅N₉O₁₂
• Molecular Weight: 687.71
• CAS Registry Number: 34787-28-5
• SMILES: [C@H]1(NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H](NC1=O)CCCN(O)C(=O)C)CCCN(O)C(=O)C)CCCN(O)C(=O)C
• InChI: 1S/C27H45N9O12/c1-16(37)34(46)10-4-7-19-25(43)30-14-23(41)28-13-22(40)29-15-24(42)31-20(8-5-11-35(47)17(2)38)26(44)33-21(27(45)32-19)9-6-12-36(48)18(3)39/h19-21,46-48H,4-15H2,1-3H3,(H,28,41)(H,29,40)(H,30,43)(H,31,42)(H,32,45)(H,33,44)/t19-,20-,21-/m0/s1
• InChIKey: ZFDAUYPBCXMSBF-ACRUOGEOSA-N