(3S)-3-azanyl-4-[[(2S)-1-[[(2S)-1-[4-[[(2S)-1-[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]carbamoyl]-1,2,3-triazol-1-yl]-5-[bis(azanyl)methylideneamino]pentan-2-yl]amino]-1-oxidanylidene-3-pyridin-3-yl-propan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-azanyl-4-[[(2S)-1-[[(2S)-1-[4-[[(2S)-1-[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]carbamoyl]-1,2,3-triazol-1-yl]-5-[bis(azanyl)methylideneamino]pentan-2-yl]amino]-1-oxidanylidene-3-pyridin-3-yl-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-amino-4-[[(1S)-2-[[(1S)-1-[[4-[[(1S)-1-[[(1S)-1-carbamoyl-3-methyl-butyl]carbamoyl]-4-guanidino-butyl]carbamoyl]triazol-1-yl]methyl]-4-guanidino-butyl]amino]-2-oxo-1-(3-pyridylmethyl)ethyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-amino-4-[[(2S)-1-[[(2S)-1-[4-[[[(2S)-1-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-oxomethyl]-1-triazolyl]-5-(diaminomethylideneamino)pentan-2-yl]amino]-1-oxo-3-(3-pyridinyl)propan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-amino-4-[[(2S)-1-[[(2S)-1-[4-[[(2S)-1-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]carbamoyl]triazol-1-yl]-5-(diaminomethylideneamino)pentan-2-yl]amino]-1-oxo-3-pyridin-3-ylpropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: (3S)-3-amino-4-[[(1S)-2-[[(1S)-1-[[4-[[(1S)-1-[[(1S)-1-carbamoyl-3-methyl-butyl]carbamoyl]-4-guanidino-butyl]carbamoyl]triazol-1-yl]methyl]-4-guanidino-butyl]amino]-2-keto-1-(3-pyridylmethyl)ethyl]amino]-4-keto-butyric acid Formula: C33H54N16O7 MolecularWeight: 786.88486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC(=O)C(CCCN=C(N)N)NC(=O)C1=CN(N=N1)CC(CCCN=C(N)N)NC(=O)C(CC2=CN=CC=C2)NC(=O)C(CC(=O)O)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)C1=CN(N=N1)C[C@H](CCCN=C(N)N)NC(=O)[C@H](CC2=CN=CC=C2)NC(=O)[C@H](CC(=O)O)N

InChI

InChI=1S/C33H54N16O7/c1-18(2)12-23(27(35)52)45-29(54)22(8-5-11-42-33(38)39)44-31(56)25-17-49(48-47-25)16-20(7-4-10-41-32(36)37)43-30(55)24(13-19-6-3-9-40-15-19)46-28(53)21(34)14-26(50)51/h3,6,9,15,17-18,20-24H,4-5,7-8,10-14,16,34H2,1-2H3,(H2,35,52)(H,43,55)(H,44,56)(H,45,54)(H,46,53)(H,50,51)(H4,36,37,41)(H4,38,39,42)/t20-,21-,22-,23-,24-/m0/s1