Aminosuberoyl(1,6)-Argipressin
[CAS# 24057-83-8]

Identification

• Name: Aminosuberoyl(1,6)-Argipressin
• Synonyms: 1-[11-(2-Amino-2-Oxo-Ethyl)-8-(3-Amino-3-Oxo-Propyl)-2-[(4-Hydroxyphenyl)Methyl]-3,6,9,12,20-Pentaoxo-5-(Phenylmethyl)1,4,7,10,13-Pentazacycloicosane-14-Carbonyl]-N-[1-[(2-Amino-2-Oxo-Ethyl)Carbamoyl]-4-Guanidino-Butyl]Pyrrolidine-2-Carboxamide; N-[1-[[(2-Amino-2-Oxoethyl)Amino]-Oxomethyl]-4-Guanidinobutyl]-1-[[11-(2-Amino-2-Oxoethyl)-8-(3-Amino-3-Oxopropyl)-2-[(4-Hydroxyphenyl)Methyl]-3,6,9,12,20-Pentaoxo-5-(Phenylmethyl)-1,4,7,10,13-Pentazacycloicos-14-Yl]-Oxomethyl]-2-Pyrrolidinecarboxamide; 1-[11-(2-Amino-2-Keto-Ethyl)-8-(3-Amino-3-Keto-Propyl)-5-(Benzyl)-2-(4-Hydroxybenzyl)-3,6,9,12,20-Pentaketo-1,4,7,10,13-Pentazacycloicosane-14-Carbonyl]-N-[1-[(2-Amino-2-Keto-Ethyl)Carbamoyl]-4-Guanidino-Butyl]Pyrrolidine-2-Carboxamide
• Molecular Formula: C₄₈H₆₈N₁₄O₁₂
• Molecular Weight: 1033.15
• CAS Registry Number: 24057-83-8
• SMILES: C4=C(CC1NC(=O)CCCCCC(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)CC2=CC=CC=C2)CCC(=O)N)CC(=O)N)C(=O)N3C(CCC3)C(=O)NC(CCCN=C(N)N)C(=O)NCC(=O)N)C=CC(=C4)O
• InChI: 1S/C48H68N14O12/c49-37(64)20-19-31-42(69)61-35(25-38(50)65)45(72)59-32(47(74)62-22-8-13-36(62)46(73)58-30(12-7-21-54-48(52)53)41(68)55-26-39(51)66)11-5-2-6-14-40(67)56-33(24-28-15-17-29(63)18-16-28)43(70)60-34(44(71)57-31)23-27-9-3-1-4-10-27/h1,3-4,9-10,15-18,30-36,63H,2,5-8,11-14,19-26H2,(H2,49,64)(H2,50,65)(H2,51,66)(H,55,68)(H,56,67)(H,57,71)(H,58,73)(H,59,72)(H,60,70)(H,61,69)(H4,52,53,54)
• InChIKey: RNZNNGJIIRKABQ-UHFFFAOYSA-N

Properties

• Density: 1.504g/cm³ (Cal.)