[6-(2,3-dihexadecoxypropoxy)-3,4,5-tris(oxidanyl)oxan-2-yl]methanesulfonic acid; sodium

Systemtic Name: [6-(2,3-dihexadecoxypropoxy)-3,4,5-tris(oxidanyl)oxan-2-yl]methanesulfonic acid; sodium Openeye Name: [6-(2,3-dihexadecoxypropoxy)-3,4,5-trihydroxy-tetrahydropyran-2-yl]methanesulfonic acid; sodium CAS Name: [6-(2,3-dihexadecoxypropoxy)-3,4,5-trihydroxy-2-oxanyl]methanesulfonic acid; sodium IUPAC Name: [6-(2,3-dihexadecoxypropoxy)-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid; sodium Traditional Name: [6-(2,3-dicetyloxypropoxy)-3,4,5-trihydroxy-tetrahydropyran-2-yl]methanesulfonic acid; sodium Formula: C41H82NaO10S MolecularWeight: 790.13855

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COC1C(C(C(C(O1)CS(=O)(=O)O)O)O)O)OCCCCCCCCCCCCCCCC.[Na]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COC1C(C(C(C(O1)CS(=O)(=O)O)O)O)O)OCCCCCCCCCCCCCCCC.[Na]

InChI

InChI=1S/C41H82O10S.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-48-33-36(34-50-41-40(44)39(43)38(42)37(51-41)35-52(45,46)47)49-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h36-44H,3-35H2,1-2H3,(H,45,46,47);