(2S)-2-azanyl-6-oxidanylidene-6-[[(2R)-1-oxidanylidene-1-[[(2R)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-sulfanyl-propan-2-yl]amino]hexanoic acid

Systemtic Name: (2S)-2-azanyl-6-oxidanylidene-6-[[(2R)-1-oxidanylidene-1-[[(2R)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-sulfanyl-propan-2-yl]amino]hexanoic acid Openeye Name: (2S)-2-amino-6-[[(1R)-2-[[(1R)-2-hydroxy-1-methyl-2-oxo-ethyl]amino]-2-oxo-1-(sulfanylmethyl)ethyl]amino]-6-oxo-hexanoic acid CAS Name: (2S)-2-amino-6-[[(2R)-1-[[(2R)-1-hydroxy-1-oxopropan-2-yl]amino]-3-mercapto-1-oxopropan-2-yl]amino]-6-oxohexanoic acid IUPAC Name: (2S)-2-amino-6-[[(2R)-1-[[(2R)-1-hydroxy-1-oxopropan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-6-oxohexanoic acid Traditional Name: (2S)-2-amino-6-[[(1R)-2-[[(1R)-2-hydroxy-2-keto-1-methyl-ethyl]amino]-2-keto-1-(mercaptomethyl)ethyl]amino]-6-keto-hexanoic acid Formula: C12H21N3O6S MolecularWeight: 335.37664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C(CS)NC(=O)CCCC(C(=O)O)N

Isomeric SMILES

C[C@H](C(=O)O)NC(=O)[C@H](CS)NC(=O)CCC[C@@H](C(=O)O)N

InChI

InChI=1S/C12H21N3O6S/c1-6(11(18)19)14-10(17)8(5-22)15-9(16)4-2-3-7(13)12(20)21/h6-8,22H,2-5,13H2,1H3,(H,14,17)(H,15,16)(H,18,19)(H,20,21)/t6-,7+,8+/m1/s1