(3S)-3-azanyl-4-[[(2S)-4-methyl-1-[[(2S)-4-methyl-1-[[(2S)-3-methyl-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-4-methylsulfanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-4-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-azanyl-4-[[(2S)-4-methyl-1-[[(2S)-4-methyl-1-[[(2S)-3-methyl-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-4-methylsulfanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-4-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-amino-4-[[(1S)-1-[[(1S)-1-[[(1S)-1-[[(1S)-1-[[(1S,2R)-1-[[(1S)-1-carboxy-3-methylsulfanyl-propyl]carbamoyl]-2-hydroxy-propyl]carbamoyl]-3-hydroxy-3-oxo-propyl]carbamoyl]-2-methyl-propyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-amino-4-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-4-hydroxy-1-[[(2S,3R)-3-hydroxy-1-[[(2S)-1-hydroxy-4-(methylthio)-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-amino-4-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-4-hydroxy-1-[[(2S,3R)-3-hydroxy-1-[[(2S)-1-hydroxy-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-oxobutanoic acid Traditional Name: (3S)-3-amino-4-[[(1S)-1-[[(1S)-1-[[(1S)-1-[[(1S)-1-[[(1S,2R)-1-[[(1S)-1-carboxy-3-(methylthio)propyl]carbamoyl]-2-hydroxy-propyl]carbamoyl]-3-hydroxy-3-keto-propyl]carbamoyl]-2-methyl-propyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]amino]-4-keto-butyric acid Formula: C34H59N7O13S MolecularWeight: 805.93636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)NC(C(C)O)C(=O)NC(CCSC)C(=O)O)NC(=O)C(CC(C)C)NC(=O)C(CC(=O)O)N

Isomeric SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)N)O

InChI

InChI=1S/C34H59N7O13S/c1-15(2)11-21(37-28(47)19(35)13-24(43)44)29(48)38-22(12-16(3)4)30(49)40-26(17(5)6)32(51)39-23(14-25(45)46)31(50)41-27(18(7)42)33(52)36-20(34(53)54)9-10-55-8/h15-23,26-27,42H,9-14,35H2,1-8H3,(H,36,52)(H,37,47)(H,38,48)(H,39,51)(H,40,49)(H,41,50)(H,43,44)(H,45,46)(H,53,54)/t18-,19+,20+,21+,22+,23+,26+,27+/m1/s1