(2S)-5-[bis(azanyl)methylideneamino]-2-[[(2S)-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-pyrrolidin-2-yl]carbonylamino]pentanoyl]amino]pentanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]pentanoic acid

Systemtic Name: (2S)-5-[bis(azanyl)methylideneamino]-2-[[(2S)-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-pyrrolidin-2-yl]carbonylamino]pentanoyl]amino]pentanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]pentanoic acid Openeye Name: (2S)-5-guanidino-2-[[(2S)-4-hydroxy-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoyl]amino]pentanoyl]amino]-4-oxo-butanoyl]amino]pentanoic acid CAS Name: (2S)-5-(diaminomethylideneamino)-2-[[(2S)-4-hydroxy-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-1-oxo-2-[[oxo-[(2S)-2-pyrrolidinyl]methyl]amino]pentyl]amino]-1-oxopentyl]amino]-1,4-dioxobutyl]amino]pentanoic acid IUPAC Name: (2S)-5-(diaminomethylideneamino)-2-[[(2S)-4-hydroxy-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoyl]amino]pentanoyl]amino]-4-oxobutanoyl]amino]pentanoic acid Traditional Name: (2S)-5-guanidino-2-[[(2S)-4-hydroxy-4-keto-2-[[(2S)-4-methyl-2-[[(2S)-4-methyl-2-[[(2S)-prolyl]amino]pentanoyl]amino]pentanoyl]amino]butanoyl]amino]valeric acid Formula: C27H48N8O8 MolecularWeight: 612.71882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC(C)C)C(=O)NC(CC(=O)O)C(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C1CCCN1

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@@H]1CCCN1

InChI

InChI=1S/C27H48N8O8/c1-14(2)11-18(33-22(38)16-7-5-9-30-16)23(39)34-19(12-15(3)4)24(40)35-20(13-21(36)37)25(41)32-17(26(42)43)8-6-10-31-27(28)29/h14-20,30H,5-13H2,1-4H3,(H,32,41)(H,33,38)(H,34,39)(H,35,40)(H,36,37)(H,42,43)(H4,28,29,31)/t16-,17-,18-,19-,20-/m0/s1