4-[2-[(4-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-3-oxidanyl-3-oxidanylidene-propyl]sulfanyl-6-methoxy-6-oxidanylidene-hexanoic acid

Systemtic Name: 4-[2-[(4-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-3-oxidanyl-3-oxidanylidene-propyl]sulfanyl-6-methoxy-6-oxidanylidene-hexanoic acid Openeye Name: 4-[2-[(4-amino-5-hydroxy-5-oxo-pentanoyl)amino]-3-hydroxy-3-oxo-propyl]sulfanyl-6-methoxy-6-oxo-hexanoic acid CAS Name: 4-[[2-[(4-amino-5-hydroxy-1,5-dioxopentyl)amino]-3-hydroxy-3-oxopropyl]thio]-6-methoxy-6-oxohexanoic acid IUPAC Name: 4-[2-[(4-amino-5-hydroxy-5-oxopentanoyl)amino]-3-hydroxy-3-oxopropyl]sulfanyl-6-methoxy-6-oxohexanoic acid Traditional Name: 4-[[2-[(4-amino-5-hydroxy-5-keto-pentanoyl)amino]-3-hydroxy-3-keto-propyl]thio]-6-keto-6-methoxy-hexanoic acid Formula: C15H24N2O9S MolecularWeight: 408.42406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CCC(=O)O)SCC(C(=O)O)NC(=O)CCC(C(=O)O)N

Isomeric SMILES

COC(=O)CC(CCC(=O)O)SCC(C(=O)O)NC(=O)CCC(C(=O)O)N

InChI

InChI=1S/C15H24N2O9S/c1-26-13(21)6-8(2-5-12(19)20)27-7-10(15(24)25)17-11(18)4-3-9(16)14(22)23/h8-10H,2-7,16H2,1H3,(H,17,18)(H,19,20)(H,22,23)(H,24,25)