[(2R,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-2-(acetyloxymethyl)-6-[2-[2-(2-octadecoxyethoxy)ethoxy]ethylsulfanyl]oxan-3-yl]oxy-oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-2-(acetyloxymethyl)-6-[2-[2-(2-octadecoxyethoxy)ethoxy]ethylsulfanyl]oxan-3-yl]oxy-oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4S,5R,6S)-3,4,5-triacetoxy-6-[(2R,3R,4S,5R,6S)-4,5-diacetoxy-2-(acetoxymethyl)-6-[2-[2-(2-octadecoxyethoxy)ethoxy]ethylsulfanyl]tetrahydropyran-3-yl]oxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-2-(acetyloxymethyl)-6-[2-[2-(2-octadecoxyethoxy)ethoxy]ethylthio]-3-oxanyl]oxy]-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[(2R,3R,4S,5R,6S)-4,5-diacetyloxy-2-(acetyloxymethyl)-6-[2-[2-(2-octadecoxyethoxy)ethoxy]ethylsulfanyl]oxan-3-yl]oxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4S,5R,6S)-3,4,5-triacetoxy-6-[(2R,3R,4S,5R,6S)-4,5-diacetoxy-2-(acetoxymethyl)-6-[2-[2-(2-stearyloxyethoxy)ethoxy]ethylthio]tetrahydropyran-3-yl]oxy-tetrahydropyran-2-yl]methyl ester Formula: C50H84O20S MolecularWeight: 1037.25496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCOCCOCCSC1C(C(C(C(O1)COC(=O)C)OC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCOCCOCCS[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C50H84O20S/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-58-26-27-59-28-29-60-30-31-71-50-48(67-40(8)57)46(65-38(6)55)44(42(69-50)33-62-35(3)52)70-49-47(66-39(7)56)45(64-37(5)54)43(63-36(4)53)41(68-49)32-61-34(2)51/h41-50H,9-33H2,1-8H3/t41-,42-,43+,44-,45+,46+,47-,48-,49+,50+/m1/s1