Hypeptin
[CAS# 124883-38-1]

Identification

• Name: Hypeptin
• Synonyms: 3-[[2-[[2-(2-Aminopropanoylamino)-4-Methyl-Pentanoyl]Amino]-5-Guanidino-Pentanoyl]Amino]-N'-[13-Carbamoyl-9-[Hydroxy-(4-Hydroxyphenyl)Methyl]-6-(1-Hydroxy-2-Methyl-Propyl)-2,5,8,11-Tetraoxo-3-Sec-Butyl-1-Oxa-4,7,10-Triazacyclotridec-12-Yl]-2-Hydroxy-Butanediamide; 3-[[2-[[2-[(2-Amino-1-Oxopropyl)Amino]-4-Methyl-1-Oxopentyl]Amino]-5-Guanidino-1-Oxopentyl]Amino]-N'-[13-Carbamoyl-9-[Hydroxy-(4-Hydroxyphenyl)Methyl]-6-(1-Hydroxy-2-Methylpropyl)-2,5,8,11-Tetraoxo-3-Sec-Butyl-1-Oxa-4,7,10-Triazacyclotridec-12-Yl]-2-Hydroxybutanediamide; 3-[[2-[[2-(Alanylamino)-4-Methyl-Pentanoyl]Amino]-5-Guanidino-Pentanoyl]Amino]-N'-[13-Carbamoyl-9-[Hydroxy-(4-Hydroxyphenyl)Methyl]-6-(1-Hydroxy-2-Methyl-Propyl)-2,5,8,11-Tetraketo-3-Sec-Butyl-1-Oxa-4,7,10-Triazacyclotridec-12-Yl]-2-Hydroxy-Succinamide
• Molecular Formula: C₄₄H₇₁N₁₃O₁₅
• Molecular Weight: 1022.12
• CAS Registry Number: 124883-38-1
• SMILES: C2=C(C(O)C1NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(N)C)CC(C)C)CCCN=C(N)N)C(O)C(=O)N)C(OC(=O)C(NC(=O)C(NC1=O)C(O)C(C)C)C(CC)C)C(=O)N)C=CC(=C2)O
• InChI: 1S/C44H71N13O15/c1-8-19(6)25-43(71)72-33(35(47)63)29(42(70)56-27(31(60)21-11-13-22(58)14-12-21)40(68)55-26(39(67)53-25)30(59)18(4)5)57-41(69)28(32(61)34(46)62)54-37(65)23(10-9-15-50-44(48)49)51-38(66)24(16-17(2)3)52-36(64)20(7)45/h11-14,17-20,23-33,58-61H,8-10,15-16,45H2,1-7H3,(H2,46,62)(H2,47,63)(H,51,66)(H,52,64)(H,53,67)(H,54,65)(H,55,68)(H,56,70)(H,57,69)(H4,48,49,50)
• InChIKey: FZKVQDUEWNYBMS-UHFFFAOYSA-N

Properties

• Density: 1.539g/cm³ (Cal.)