2-[[2-[2-[2-[[2-[[2-[2-[2-[(2-azanyl-4-methyl-pentanoyl)amino]propanoylamino]ethanoylamino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]ethanoylamino]-3-methyl-butanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-[2-[2-[[2-[[2-[2-[2-[(2-azanyl-4-methyl-pentanoyl)amino]propanoylamino]ethanoylamino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]ethanoylamino]-3-methyl-butanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-[[2-[2-[[2-[[2-[[2-[2-[(2-amino-4-methyl-pentanoyl)amino]propanoylamino]acetyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]acetyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-3-methyl-1-oxobutyl]amino]-4-methyl-1-oxopentyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-3-methyl-1-oxobutyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-[[2-[2-[[2-[[2-[[2-[2-[(2-amino-4-methylpentanoyl)amino]propanoylamino]acetyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]propanoylamino]acetyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[[2-[2-[[2-[[2-[[2-[2-[(2-amino-4-methyl-pentanoyl)amino]propanoylamino]acetyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]acetyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propionic acid Formula: C41H67N9O10 MolecularWeight: 846.02498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)C(=O)NCC(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NCC(=O)NC(C(C)C)C(=O)NC(CC1=CC=CC=C1)C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)NC(C)C(=O)NCC(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NCC(=O)NC(C(C)C)C(=O)NC(CC1=CC=CC=C1)C(=O)O)N

InChI

InChI=1S/C41H67N9O10/c1-21(2)16-28(42)37(55)45-25(9)35(53)43-19-31(51)49-33(23(5)6)39(57)47-29(17-22(3)4)38(56)46-26(10)36(54)44-20-32(52)50-34(24(7)8)40(58)48-30(41(59)60)18-27-14-12-11-13-15-27/h11-15,21-26,28-30,33-34H,16-20,42H2,1-10H3,(H,43,53)(H,44,54)(H,45,55)(H,46,56)(H,47,57)(H,48,58)(H,49,51)(H,50,52)(H,59,60)