De-ile(1)-de-asn(2)-mastoparan
[CAS# 107048-32-8]

Identification

• Name: De-ile(1)-de-asn(2)-mastoparan
• Synonyms: (2S)-6-Amino-2-[[6-Amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-Amino-2-[[(2S)-2-Amino-4-Methyl-Pentanoyl]Amino]Hexanoyl]Amino]Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]Propanoyl]Amino]Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]Propanoyl]Amino]Hexanoyl]Amino]-N-[(1S,2S)-1-[[(1S)-1-Carbamoyl-3-Methyl-Butyl]Carbamoyl]-2-Methyl-Butyl]Hexanamide; (2S)-6-Amino-2-[[6-Amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-Amino-2-[[(2S)-2-Amino-4-Methyl-1-Oxopentyl]Amino]-1-Oxohexyl]Amino]-1-Oxopropyl]Amino]-4-Methyl-1-Oxopentyl]Amino]-1-Oxopropyl]Amino]-1-Oxopropyl]Amino]-4-Methyl-1-Oxopentyl]Amino]-1-Oxopropyl]Amino]-1-Oxohexyl]Amino]-N-[(1S,2S)-1-[[[(1S)-1-Carbamoyl-3-Methylbutyl]Amino]-Oxomethyl]-2-Methylbutyl]Hexanamide; (2S)-6-Amino-2-[[6-Amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-Amino-2-[[(2S)-2-Amino-4-Methyl-Pentanoyl]Amino]Hexanoyl]Amino]Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]Propanoyl]Amino]Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]Propanoyl]Amino]Hexanoyl]Amino]-N-[(2S,3S)-1-[[(2S)-1-Amino-4-Methyl-1-Oxo-Pentan-2-Yl]Amino]-3-Methyl-1-Oxo-Pentan-2-Yl]Hexanamide
• Molecular Formula: C₆₀H₁₁₄N₁₆O₁₂
• Molecular Weight: 1251.66
• CAS Registry Number: 107048-32-8
• SMILES: [C@@H](NC(=O)[C@@H](NC(=O)C(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)CCCCN)C)CC(C)C)C)C)CC(C)C)C)CCCCN)CCCCN)(C(=O)N[C@H](C(=O)N)CC(C)C)[C@H](CC)C
• InChI: 1S/C60H114N16O12/c1-15-36(10)48(60(88)73-45(49(65)77)29-33(4)5)76-57(85)44(24-18-21-27-63)72-56(84)43(23-17-20-26-62)70-51(79)39(13)69-59(87)47(31-35(8)9)74-52(80)38(12)66-50(78)37(11)68-58(86)46(30-34(6)7)75-53(81)40(14)67-55(83)42(22-16-19-25-61)71-54(82)41(64)28-32(2)3/h32-48H,15-31,61-64H2,1-14H3,(H2,65,77)(H,66,78)(H,67,83)(H,68,86)(H,69,87)(H,70,79)(H,71,82)(H,72,84)(H,73,88)(H,74,80)(H,75,81)(H,76,85)/t36-,37-,38-,39-,40-,41-,42-,43?,44-,45-,46-,47-,48-/m0/s1
• InChIKey: YMMUNCDECKRLBO-NDUJRAGXSA-N

Properties

• Density: 1.132g/cm³ (Cal.)
• Boiling point: 1492.206°C at 760 mmHg (Cal.)
• Flash point: 856.255°C (Cal.)