(2S)-2-[[2-[[1-[8-azanyl-4,6-dimethyl-9-[1-[[2-[[(2S)-3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-2-oxidanylidene-ethanoyl]amino]-2-oxidanyl-propyl]-7-oxidanylidene-phenoxazin-1-yl]-2-oxidanyl-propyl]amino]-2-oxidanylidene-ethanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[2-[[1-[8-azanyl-4,6-dimethyl-9-[1-[[2-[[(2S)-3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-2-oxidanylidene-ethanoyl]amino]-2-oxidanyl-propyl]-7-oxidanylidene-phenoxazin-1-yl]-2-oxidanyl-propyl]amino]-2-oxidanylidene-ethanoyl]amino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[2-[[1-[8-amino-9-[1-[[2-[[(1S)-1-carboxy-2-methyl-propyl]amino]-2-oxo-acetyl]amino]-2-hydroxy-propyl]-4,6-dimethyl-7-oxo-phenoxazin-1-yl]-2-hydroxy-propyl]amino]-2-oxo-acetyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[2-[[1-[8-amino-9-[2-hydroxy-1-[[2-[[(2S)-1-hydroxy-3-methyl-1-oxobutan-2-yl]amino]-1,2-dioxoethyl]amino]propyl]-4,6-dimethyl-7-oxo-1-phenoxazinyl]-2-hydroxypropyl]amino]-1,2-dioxoethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[2-[[1-[8-amino-9-[2-hydroxy-1-[[2-[[(2S)-1-hydroxy-3-methyl-1-oxobutan-2-yl]amino]-2-oxoacetyl]amino]propyl]-4,6-dimethyl-7-oxophenoxazin-1-yl]-2-hydroxypropyl]amino]-2-oxoacetyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[2-[[1-[8-amino-9-[1-[[2-[[(1S)-1-carboxy-2-methyl-propyl]amino]-2-keto-acetyl]amino]-2-hydroxy-propyl]-7-keto-4,6-dimethyl-phenoxazin-1-yl]-2-hydroxy-propyl]amino]-2-keto-acetyl]amino]-3-methyl-butyric acid Formula: C34H44N6O12 MolecularWeight: 728.74616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C(C(C)O)NC(=O)C(=O)NC(C(C)C)C(=O)O)N=C3C(=C(C(=O)C(=C3O2)C)N)C(C(C)O)NC(=O)C(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=C2C(=C(C=C1)C(C(C)O)NC(=O)C(=O)N[C@@H](C(C)C)C(=O)O)N=C3C(=C(C(=O)C(=C3O2)C)N)C(C(C)O)NC(=O)C(=O)N[C@@H](C(C)C)C(=O)O

InChI

InChI=1S/C34H44N6O12/c1-11(2)20(33(48)49)37-29(44)31(46)39-22(15(7)41)17-10-9-13(5)27-24(17)36-25-18(19(35)26(43)14(6)28(25)52-27)23(16(8)42)40-32(47)30(45)38-21(12(3)4)34(50)51/h9-12,15-16,20-23,41-42H,35H2,1-8H3,(H,37,44)(H,38,45)(H,39,46)(H,40,47)(H,48,49)(H,50,51)/t15?,16?,20-,21-,22?,23?/m0/s1