D-Arginyl-L-Arginyl-L-Prolyl-(4R)-4-Hydroxy-L-Prolylglycyl-L-Phenylalanyl-L-Seryl-D-Phenylalanyl-L-Leucyl-L-Arginine
[CAS# 135701-67-6]

Identification

• Name: D-Arginyl-L-Arginyl-L-Prolyl-(4R)-4-Hydroxy-L-Prolylglycyl-L-Phenylalanyl-L-Seryl-D-Phenylalanyl-L-Leucyl-L-Arginine
• Synonyms: [(2S)-5-Guanidino-2-[[(2S)-2-[[(2R)-2-[[(2S)-3-Hydroxy-2-[[(2S)-2-[[2-[[(2S,4R)-4-Hydroxypyrrolidine-2-Carbonyl]Amino]Acetyl]Amino]-3-Phenyl-Propanoyl]Amino]Propanoyl]Amino]-3-Phenyl-Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]Pentanoyl] (2S)-1-[(2S)-2-[[(2R)-2-Amino-5-Guanidino-Pentanoyl]Amino]-5-Guanidino-Pentanoyl]Pyrrolidine-2-Carboxylate; (2S)-1-[(2S)-2-[[(2R)-2-Amino-5-Guanidino-1-Oxopentyl]Amino]-5-Guanidino-1-Oxopentyl]-2-Pyrrolidinecarboxylic Acid [(2S)-5-Guanidino-2-[[(2S)-2-[[(2R)-2-[[(2S)-3-Hydroxy-2-[[(2S)-2-[[2-[[[(2S,4R)-4-Hydroxy-2-Pyrrolidinyl]-Oxomethyl]Amino]-1-Oxoethyl]Amino]-1-Oxo-3-Phenylpropyl]Amino]-1-Oxopropyl]Amino]-1-Oxo-3-Phenylpropyl]Amino]-4-Methyl-1-Oxopentyl]Amino]-1-Oxopentyl] Ester; (2S)-1-[(2S)-2-[[(2R)-2-Amino-5-Guanidino-Pentanoyl]Amino]-5-Guanidino-Pentanoyl]Pyrrolidine-2-Carboxylic Acid [(2S)-5-Guanidino-2-[[(2S)-2-[[(2R)-2-[[(2S)-3-Hydroxy-2-[[(2S)-2-[[2-[[(2S,4R)-4-Hydroxypyrrolidine-2-Carbonyl]Amino]Acetyl]Amino]-3-Phenyl-Propanoyl]Amino]Propanoyl]Amino]-3-Phenyl-Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]Pentanoyl] Ester
• Molecular Formula: C₅₇H₈₉N₁₉O₁₃
• Molecular Weight: 1248.45
• CAS Registry Number: 135701-67-6
• SMILES: [C@@H]1(N(CCC1)C(=O)[C@@H](NC(=O)[C@H](N)CCCN=C(N)N)CCCN=C(N)N)C(OC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]2NC[C@H](O)C2)CC3=CC=CC=C3)CO)CC4=CC=CC=C4)CC(C)C)CCCN=C(N)N)=O
• InChI: 1S/C57H89N19O13/c1-32(2)25-40(48(82)72-38(19-11-23-67-57(63)64)53(87)89-54(88)44-20-12-24-76(44)52(86)37(18-10-22-66-56(61)62)71-46(80)36(58)17-9-21-65-55(59)60)73-50(84)42(27-34-15-7-4-8-16-34)74-51(85)43(31-77)75-49(83)41(26-33-13-5-3-6-14-33)70-45(79)30-69-47(81)39-28-35(78)29-68-39/h3-8,13-16,32,35-44,68,77-78H,9-12,17-31,58H2,1-2H3,(H,69,81)(H,70,79)(H,71,80)(H,72,82)(H,73,84)(H,74,85)(H,75,83)(H4,59,60,65)(H4,61,62,66)(H4,63,64,67)/t35-,36-,37+,38+,39+,40+,41+,42-,43+,44+/m1/s1
• InChIKey: IBUPLVFJDPVVRN-AFIJWGRYSA-N

Properties

• Density: 1.481g/cm³ (Cal.)