(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-azanylpropanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]propanoyl]amino]-5-[[(2S)-1-[[(2S)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-azanylpropanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]propanoyl]amino]-5-[[(2S)-1-[[(2S)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-5-guanidino-pentanoyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]propanoyl]amino]-5-[[(1S)-2-[[(1S)-1-formyl-3-methylsulfanyl-propyl]amino]-1-methyl-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-1-oxopropyl]amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-3-methyl-1-oxobutyl]amino]-4-methyl-1-oxopentyl]amino]-1-oxopropyl]amino]-5-[[(2S)-1-[[(2S)-4-(methylthio)-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]-5-[[(2S)-1-[[(2S)-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-5-guanidino-pentanoyl]amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]propanoyl]amino]-5-[[(1S)-2-[[(1S)-1-formyl-3-(methylthio)propyl]amino]-2-keto-1-methyl-ethyl]amino]-5-keto-valeric acid Formula: C36H65N11O10S MolecularWeight: 844.034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)C(=O)NC(CCC(=O)O)C(=O)NC(C)C(=O)NC(CCSC)C=O)NC(=O)C(C(C)C)NC(=O)C(CCCN=C(N)N)NC(=O)C(C)N

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C=O)N

InChI

InChI=1S/C36H65N11O10S/c1-18(2)16-26(46-35(57)28(19(3)4)47-33(55)24(44-29(51)20(5)37)10-9-14-40-36(38)39)34(56)42-22(7)31(53)45-25(11-12-27(49)50)32(54)41-21(6)30(52)43-23(17-48)13-15-58-8/h17-26,28H,9-16,37H2,1-8H3,(H,41,54)(H,42,56)(H,43,52)(H,44,51)(H,45,53)(H,46,57)(H,47,55)(H,49,50)(H4,38,39,40)/t20-,21-,22-,23-,24-,25-,26-,28-/m0/s1