2-(7-azanylheptylsulfanyl)-6-(hydroxymethyl)oxane-3,4,5-triol

Systemtic Name: 2-(7-azanylheptylsulfanyl)-6-(hydroxymethyl)oxane-3,4,5-triol Openeye Name: 2-(7-aminoheptylsulfanyl)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol CAS Name: 2-(7-aminoheptylthio)-6-(hydroxymethyl)oxane-3,4,5-triol IUPAC Name: 2-(7-aminoheptylsulfanyl)-6-(hydroxymethyl)oxane-3,4,5-triol Traditional Name: 2-(7-aminoheptylthio)-6-methylol-tetrahydropyran-3,4,5-triol Formula: C13H27NO5S MolecularWeight: 309.42218

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCN)CCCSC1C(C(C(C(O1)CO)O)O)O

Isomeric SMILES

C(CCCN)CCCSC1C(C(C(C(O1)CO)O)O)O

InChI

InChI=1S/C13H27NO5S/c14-6-4-2-1-3-5-7-20-13-12(18)11(17)10(16)9(8-15)19-13/h9-13,15-18H,1-8,14H2