(3R,4S,5S,6R)-2-heptan-2-yloxy-6-(hydroxymethyl)oxane-3,4,5-triol

Systemtic Name: (3R,4S,5S,6R)-2-heptan-2-yloxy-6-(hydroxymethyl)oxane-3,4,5-triol Openeye Name: (2R,3S,4S,5R)-2-(hydroxymethyl)-6-(1-methylhexoxy)tetrahydropyran-3,4,5-triol CAS Name: (3R,4S,5S,6R)-2-heptan-2-yloxy-6-(hydroxymethyl)oxane-3,4,5-triol IUPAC Name: (3R,4S,5S,6R)-2-heptan-2-yloxy-6-(hydroxymethyl)oxane-3,4,5-triol Traditional Name: (3R,4S,5S,6R)-2-(1-methylhexoxy)-6-methylol-tetrahydropyran-3,4,5-triol Formula: C13H26O6 MolecularWeight: 278.34194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)OC1C(C(C(C(O1)CO)O)O)O

Isomeric SMILES

CCCCCC(C)OC1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O

InChI

InChI=1S/C13H26O6/c1-3-4-5-6-8(2)18-13-12(17)11(16)10(15)9(7-14)19-13/h8-17H,3-7H2,1-2H3/t8?,9-,10-,11+,12-,13?/m1/s1