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

Systemtic Name: [6-hexadecoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methanesulfonic acid; sodium Openeye Name: (6-hexadecoxy-3,4,5-trihydroxy-tetrahydropyran-2-yl)methanesulfonic acid; sodium CAS Name: (6-hexadecoxy-3,4,5-trihydroxy-2-oxanyl)methanesulfonic acid; sodium IUPAC Name: (6-hexadecoxy-3,4,5-trihydroxyoxan-2-yl)methanesulfonic acid; sodium Traditional Name: (6-cetyloxy-3,4,5-trihydroxy-tetrahydropyran-2-yl)methanesulfonic acid; sodium Formula: C22H44NaO8S MolecularWeight: 491.63473

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1C(C(C(C(O1)CS(=O)(=O)O)O)O)O.[Na]

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1C(C(C(C(O1)CS(=O)(=O)O)O)O)O.[Na]

InChI

InChI=1S/C22H44O8S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-29-22-21(25)20(24)19(23)18(30-22)17-31(26,27)28;/h18-25H,2-17H2,1H3,(H,26,27,28);