(2S,3R)-2-[[(2S)-1-[[2-[(1R)-1-[[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-2-(4-hydroxyphenyl)ethyl]-1,3-oxazol-4-yl]carbonyl]pyrrolidin-2-yl]carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: (2S,3R)-2-[[(2S)-1-[[2-[(1R)-1-[[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-2-(4-hydroxyphenyl)ethyl]-1,3-oxazol-4-yl]carbonyl]pyrrolidin-2-yl]carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: (2S,3R)-2-[[(2S)-1-[2-[(1R)-1-[[(2S)-2-amino-5-guanidino-pentanoyl]amino]-2-(4-hydroxyphenyl)ethyl]oxazole-4-carbonyl]pyrrolidine-2-carbonyl]amino]-3-hydroxy-butanoic acid CAS Name: (2S,3R)-2-[[[(2S)-1-[[2-[(1R)-1-[[(2S)-2-amino-5-(diaminomethylideneamino)-1-oxopentyl]amino]-2-(4-hydroxyphenyl)ethyl]-4-oxazolyl]-oxomethyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-hydroxybutanoic acid IUPAC Name: (2S,3R)-2-[[(2S)-1-[2-[(1R)-1-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-2-(4-hydroxyphenyl)ethyl]-1,3-oxazole-4-carbonyl]pyrrolidine-2-carbonyl]amino]-3-hydroxybutanoic acid Traditional Name: (2S,3R)-2-[[(2S)-1-[2-[(1R)-1-[[(2S)-2-amino-5-guanidino-pentanoyl]amino]-2-(4-hydroxyphenyl)ethyl]oxazole-4-carbonyl]prolyl]amino]-3-hydroxy-butyric acid Formula: C27H38N8O8 MolecularWeight: 602.63942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1CCCN1C(=O)C2=COC(=N2)C(CC3=CC=C(C=C3)O)NC(=O)C(CCCN=C(N)N)N)O

Isomeric SMILES

C[C@H]([C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)C2=COC(=N2)[C@@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CCCN=C(N)N)N)O

InChI

InChI=1S/C27H38N8O8/c1-14(36)21(26(41)42)34-23(39)20-5-3-11-35(20)25(40)19-13-43-24(33-19)18(12-15-6-8-16(37)9-7-15)32-22(38)17(28)4-2-10-31-27(29)30/h6-9,13-14,17-18,20-21,36-37H,2-5,10-12,28H2,1H3,(H,32,38)(H,34,39)(H,41,42)(H4,29,30,31)/t14-,17+,18-,20+,21+/m1/s1