sodium zinc 2-[6,8-bis(sulfanyl)octanoylamino]-3-oxidanyl-butanoate

Systemtic Name: sodium zinc 2-[6,8-bis(sulfanyl)octanoylamino]-3-oxidanyl-butanoate Openeye Name: sodium zinc 2-[6,8-bis(sulfanyl)octanoylamino]-3-hydroxy-butanoate CAS Name: sodium zinc 2-[(6,8-dimercapto-1-oxooctyl)amino]-3-hydroxybutanoate IUPAC Name: sodium zinc 2-[6,8-bis(sulfanyl)octanoylamino]-3-hydroxybutanoate Traditional Name: sodium zinc 2-(6,8-dimercaptooctanoylamino)-3-hydroxy-butyrate Formula: C24H44N2NaO8S4Zn+ MolecularWeight: 705.27353

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NC(=O)CCCCC(CCS)S)O.CC(C(C(=O)[O-])NC(=O)CCCCC(CCS)S)O.[Na+].[Zn+2]

Isomeric SMILES

CC(C(C(=O)[O-])NC(=O)CCCCC(CCS)S)O.CC(C(C(=O)[O-])NC(=O)CCCCC(CCS)S)O.[Na+].[Zn+2]

InChI

InChI=1S/2C12H23NO4S2.Na.Zn/c2*1-8(14)11(12(16)17)13-10(15)5-3-2-4-9(19)6-7-18;;/h2*8-9,11,14,18-19H,2-7H2,1H3,(H,13,15)(H,16,17);;/q;;+1;+2/p-2