2-(hexanoylamino)-3-[[2-(hexanoylamino)-3-oxidanyl-3-oxidanylidene-propyl]disulfanyl]propanoic acid

Systemtic Name: 2-(hexanoylamino)-3-[[2-(hexanoylamino)-3-oxidanyl-3-oxidanylidene-propyl]disulfanyl]propanoic acid Openeye Name: 2-(hexanoylamino)-3-[[2-(hexanoylamino)-3-hydroxy-3-oxo-propyl]disulfanyl]propanoic acid CAS Name: 3-[[3-hydroxy-3-oxo-2-(1-oxohexylamino)propyl]disulfanyl]-2-(1-oxohexylamino)propanoic acid IUPAC Name: 2-(hexanoylamino)-3-[[2-(hexanoylamino)-3-hydroxy-3-oxopropyl]disulfanyl]propanoic acid Traditional Name: 2-(caproylamino)-3-[[2-(caproylamino)-3-hydroxy-3-keto-propyl]disulfanyl]propionic acid Formula: C18H32N2O6S2 MolecularWeight: 436.58648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(CSSCC(C(=O)O)NC(=O)CCCCC)C(=O)O

Isomeric SMILES

CCCCCC(=O)NC(CSSCC(C(=O)O)NC(=O)CCCCC)C(=O)O

InChI

InChI=1S/C18H32N2O6S2/c1-3-5-7-9-15(21)19-13(17(23)24)11-27-28-12-14(18(25)26)20-16(22)10-8-6-4-2/h13-14H,3-12H2,1-2H3,(H,19,21)(H,20,22)(H,23,24)(H,25,26)