(2R,3R,4R,5S)-2,3,4,5,6-pentakis(oxidanyl)-N-[2-[2-[[(2R,3R,4R,5S)-2,3,4,5,6-pentakis(oxidanyl)hexanoyl]amino]ethyldisulfanyl]ethyl]hexanamide

Systemtic Name: (2R,3R,4R,5S)-2,3,4,5,6-pentakis(oxidanyl)-N-[2-[2-[[(2R,3R,4R,5S)-2,3,4,5,6-pentakis(oxidanyl)hexanoyl]amino]ethyldisulfanyl]ethyl]hexanamide Openeye Name: (2R,3R,4R,5S)-2,3,4,5,6-pentahydroxy-N-[2-[2-[[(2R,3R,4R,5S)-2,3,4,5,6-pentahydroxyhexanoyl]amino]ethyldisulfanyl]ethyl]hexanamide CAS Name: (2R,3R,4R,5S)-2,3,4,5,6-pentahydroxy-N-[2-[2-[[(2R,3R,4R,5S)-2,3,4,5,6-pentahydroxy-1-oxohexyl]amino]ethyldisulfanyl]ethyl]hexanamide IUPAC Name: (2R,3R,4R,5S)-2,3,4,5,6-pentahydroxy-N-[2-[2-[[(2R,3R,4R,5S)-2,3,4,5,6-pentahydroxyhexanoyl]amino]ethyldisulfanyl]ethyl]hexanamide Traditional Name: (2R,3R,4R,5S)-2,3,4,5,6-pentahydroxy-N-[2-[2-[[(2R,3R,4R,5S)-2,3,4,5,6-pentahydroxyhexanoyl]amino]ethyldisulfanyl]ethyl]hexanamide Formula: C16H32N2O12S2 MolecularWeight: 508.56148

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Descriptors Computed from Structure

Canonical SMILES:

C(CSSCCNC(=O)C(C(C(C(CO)O)O)O)O)NC(=O)C(C(C(C(CO)O)O)O)O

Isomeric SMILES

C(CSSCCNC(=O)[C@@H]([C@@H]([C@@H]([C@H](CO)O)O)O)O)NC(=O)[C@@H]([C@@H]([C@@H]([C@H](CO)O)O)O)O

InChI

InChI=1S/C16H32N2O12S2/c19-5-7(21)9(23)11(25)13(27)15(29)17-1-3-31-32-4-2-18-16(30)14(28)12(26)10(24)8(22)6-20/h7-14,19-28H,1-6H2,(H,17,29)(H,18,30)/t7-,8-,9+,10+,11+,12+,13+,14+/m0/s1