2-azanyl-4,6-dimethyl-N1-[(2S,3R)-1-[[(2R)-3-methyl-2-(methylamino)butanoyl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]-N9-[1-[[3-methyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]-3-oxidanylidene-phenoxazine-1,9-dicarboxamide

Systemtic Name: 2-azanyl-4,6-dimethyl-N1-[(2S,3R)-1-[[(2R)-3-methyl-2-(methylamino)butanoyl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]-N9-[1-[[3-methyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]-3-oxidanylidene-phenoxazine-1,9-dicarboxamide Openeye Name: 2-amino-N1-[(1S,2R)-2-hydroxy-1-[[(2R)-3-methyl-2-(methylamino)butanoyl]carbamoyl]propyl]-N9-[2-hydroxy-1-[[2-methyl-1-(methylcarbamoyl)propyl]carbamoyl]propyl]-4,6-dimethyl-3-oxo-phenoxazine-1,9-dicarboxamide CAS Name: 2-amino-N9-[3-hydroxy-1-[[3-methyl-1-(methylamino)-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-N1-[(2S,3R)-3-hydroxy-1-[[(2R)-3-methyl-2-(methylamino)-1-oxobutyl]amino]-1-oxobutan-2-yl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide IUPAC Name: 2-amino-1-N-[(2S,3R)-3-hydroxy-1-[[(2R)-3-methyl-2-(methylamino)butanoyl]amino]-1-oxobutan-2-yl]-9-N-[3-hydroxy-1-[[3-methyl-1-(methylamino)-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide Traditional Name: 2-amino-N-[(1S,2R)-2-hydroxy-1-[[(2R)-3-methyl-2-(methylamino)butanoyl]carbamoyl]propyl]-N'-[2-hydroxy-1-[[2-methyl-1-(methylcarbamoyl)propyl]carbamoyl]propyl]-3-keto-4,6-dimethyl-phenoxazine-1,9-dicarboxamide Formula: C36H50N8O10 MolecularWeight: 754.8298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H50N8O10/c1-13(2)22(38-9)34(51)44-36(53)25(18(8)46)43-32(49)20-21(37)28(47)16(6)30-27(20)40-26-19(12-11-15(5)29(26)54-30)31(48)42-24(17(7)45)35(52)41-23(14(3)4)33(50)39-10/h11-14,17-18,22-25,38,45-46H,37H2,1-10H3,(H,39,50)(H,41,52)(H,42,48)(H,43,49)(H,44,51,53)/t17?,18-,22-,23?,24?,25+/m1/s1