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

Systemtic Name: (2S)-2-azanyl-6-oxidanylidene-6-[[(2R)-1-oxidanylidene-1-[[(2S)-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]-3-sulfanyl-propan-2-yl]amino]hexanoic acid Openeye Name: (2S)-2-amino-6-[[(1R)-2-[[(1S)-1-carboxypropyl]amino]-2-oxo-1-(sulfanylmethyl)ethyl]amino]-6-oxo-hexanoic acid CAS Name: (2S)-2-amino-6-[[(2R)-1-[[(2S)-1-hydroxy-1-oxobutan-2-yl]amino]-3-mercapto-1-oxopropan-2-yl]amino]-6-oxohexanoic acid IUPAC Name: (2S)-2-amino-6-[[(2R)-1-[[(2S)-1-hydroxy-1-oxobutan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-6-oxohexanoic acid Traditional Name: (2S)-2-amino-6-[[(1R)-2-[[(1S)-1-carboxypropyl]amino]-2-keto-1-(mercaptomethyl)ethyl]amino]-6-keto-hexanoic acid Formula: C13H23N3O6S MolecularWeight: 349.40322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23N3O6S/c1-2-8(13(21)22)16-11(18)9(6-23)15-10(17)5-3-4-7(14)12(19)20/h7-9,23H,2-6,14H2,1H3,(H,15,17)(H,16,18)(H,19,20)(H,21,22)/t7-,8-,9-/m0/s1