(2R,3S,4S,5R)-2-(hydroxymethyl)-6-pentacosan-13-yloxy-oxane-3,4,5-triol

Systemtic Name: (2R,3S,4S,5R)-2-(hydroxymethyl)-6-pentacosan-13-yloxy-oxane-3,4,5-triol Openeye Name: (3R,4S,5S,6R)-2-(1-dodecyltridecoxy)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol CAS Name: (2R,3S,4S,5R)-2-(hydroxymethyl)-6-pentacosan-13-yloxyoxane-3,4,5-triol IUPAC Name: (2R,3S,4S,5R)-2-(hydroxymethyl)-6-pentacosan-13-yloxyoxane-3,4,5-triol Traditional Name: (3R,4S,5S,6R)-2-(1-lauryltridecoxy)-6-methylol-tetrahydropyran-3,4,5-triol Formula: C31H62O6 MolecularWeight: 530.82038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCCCCC)OC1C(C(C(C(O1)CO)O)O)O

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCCCCC)OC1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O

InChI

InChI=1S/C31H62O6/c1-3-5-7-9-11-13-15-17-19-21-23-26(24-22-20-18-16-14-12-10-8-6-4-2)36-31-30(35)29(34)28(33)27(25-32)37-31/h26-35H,3-25H2,1-2H3/t27-,28-,29+,30-,31?/m1/s1