(2S)-2-azanyl-5-[[(2R)-1-[[(4S)-4-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]-(carboxymethyl)amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[[(2R)-1-[[(4S)-4-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]-(carboxymethyl)amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[[(1R)-2-[[(4S)-4-amino-5-hydroxy-5-oxo-pentanoyl]-(carboxymethyl)amino]-2-oxo-1-(sulfanylmethyl)ethyl]amino]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[[(2R)-1-[[(4S)-4-amino-5-hydroxy-1,5-dioxopentyl]-(carboxymethyl)amino]-3-mercapto-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[[(2R)-1-[[(4S)-4-amino-5-hydroxy-5-oxopentanoyl]-(carboxymethyl)amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-[[(1R)-2-[[(4S)-4-amino-5-hydroxy-5-keto-pentanoyl]-(carboxymethyl)amino]-2-keto-1-(mercaptomethyl)ethyl]amino]-5-keto-valeric acid Formula: C15H24N4O9S MolecularWeight: 436.43746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N4O9S/c16-7(14(25)26)1-3-10(20)18-9(6-29)13(24)19(5-12(22)23)11(21)4-2-8(17)15(27)28/h7-9,29H,1-6,16-17H2,(H,18,20)(H,22,23)(H,25,26)(H,27,28)/t7-,8-,9-/m0/s1