Locustamyotropin I
[CAS# 129192-62-7]

Identification

• Name: Locustamyotropin I
• Synonyms: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[(2-Aminoacetyl)Amino]Propanoyl]Amino]-3-Methyl-Butanoyl]Pyrrolidine-2-Carbonyl]Amino]Propanoyl]Amino]Propanoyl]Amino]-N-[(1S)-2-[[(1S)-2-[(2S)-2-[[(1S)-1-[[(1S)-1-Carbamoyl-3-Methyl-Butyl]Carbamoyl]-4-Guanidino-Butyl]Carbamoyl]Pyrrolidin-1-Yl]-1-(Hydroxymethyl)-2-Oxo-Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Pentanediamide; (2S)-2-[[(2S)-2-[[(2S)-2-[[[(2S)-1-[(2S)-2-[[(2S)-2-[(2-Amino-1-Oxoethyl)Amino]-1-Oxopropyl]Amino]-3-Methyl-1-Oxobutyl]-2-Pyrrolidinyl]-Oxomethyl]Amino]-1-Oxopropyl]Amino]-1-Oxopropyl]Amino]-N-[(1S)-2-[[(1S)-2-[(2S)-2-[[[(1S)-1-[[[(1S)-1-Carbamoyl-3-Methylbutyl]Amino]-Oxomethyl]-4-Guanidinobutyl]Amino]-Oxomethyl]-1-Pyrrolidinyl]-1-(Hydroxymethyl)-2-Oxoethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Pentanediamide; (2S)-N-[(1S)-1-(Benzyl)-2-[[(1S)-2-[(2S)-2-[[(1S)-1-[[(1S)-1-Carbamoyl-3-Methyl-Butyl]Carbamoyl]-4-Guanidino-Butyl]Carbamoyl]Pyrrolidin-1-Yl]-2-Keto-1-Methylol-Ethyl]Amino]-2-Keto-Ethyl]-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-(Glycylamino)Propanoyl]Amino]-3-Methyl-Butanoyl]Pyrrolidine-2-Carbonyl]Amino]Propanoyl]Amino]Propanoyl]Amino]Glutaramide
• Molecular Formula: C₅₅H₈₉N₁₇O₁₄
• Molecular Weight: 1212.41
• CAS Registry Number: 129192-62-7
• SMILES: [C@@H]1(N(CCC1)C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CN)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2[C@@H](CCC2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N)CO)CC3=CC=CC=C3)CCC(=O)N)C
• InChI: 1S/C55H89N17O14/c1-28(2)24-36(44(58)76)67-48(80)34(16-11-21-61-55(59)60)66-52(84)40-18-12-22-71(40)53(85)38(27-73)69-50(82)37(25-33-14-9-8-10-15-33)68-49(81)35(19-20-41(57)74)65-46(78)32(7)63-45(77)31(6)64-51(83)39-17-13-23-72(39)54(86)43(29(3)4)70-47(79)30(5)62-42(75)26-56/h8-10,14-15,28-32,34-40,43,73H,11-13,16-27,56H2,1-7H3,(H2,57,74)(H2,58,76)(H,62,75)(H,63,77)(H,64,83)(H,65,78)(H,66,84)(H,67,80)(H,68,81)(H,69,82)(H,70,79)(H4,59,60,61)/t30-,31-,32-,34-,35-,36-,37-,38-,39-,40-,43-/m0/s1
• InChIKey: NPNBMKDPZYWGOL-LSMZMZNBSA-N

Properties

• Density: 1.451g/cm³ (Cal.)