Alanyl-arginyl-arginylmethyldimethylsulfonium
[CAS# 120218-55-5]

Identification

• Name: Alanyl-arginyl-arginylmethyldimethylsulfonium
• Synonyms: [(3S)-3-[[(1S)-1-[[(2S)-2-Aminopropanoyl]Carbamoyl]-4-Guanidino-Butyl]Amino]-6-Guanidino-2-Oxo-Hexyl]-Dimethyl-Sulfonium; [(3S)-3-[[(1S)-1-[[[(2S)-2-Amino-1-Oxopropyl]Amino]-Oxomethyl]-4-Guanidinobutyl]Amino]-6-Guanidino-2-Oxohexyl]-Dimethylsulfonium; [(3S)-3-[[(1S)-1-(Alanylcarbamoyl)-4-Guanidino-Butyl]Amino]-6-Guanidino-2-Keto-Hexyl]-Dimethyl-Sulfonium
• Molecular Formula: C₁₈H₃₈N₉O₃S
• Molecular Weight: 460.62
• CAS Registry Number: 120218-55-5
• SMILES: [C@H](N[C@@H](CCCN=C(N)N)C(=O)NC(=O)[C@@H](N)C)(CCCN=C(N)N)C(=O)C[S+](C)C
• InChI: 1S/C18H37N9O3S/c1-11(19)15(29)27-16(30)13(7-5-9-25-18(22)23)26-12(14(28)10-31(2)3)6-4-8-24-17(20)21/h11-13,26H,4-10,19H2,1-3H3,(H8-,20,21,22,23,24,25,27,29,30)/p+1/t11-,12-,13-/m0/s1
• InChIKey: VDNLEFRUCMFFHH-AVGNSLFASA-O