[(2R,3R,4S,5R,6R)-4-acetyloxy-6-hexadecoxy-3-oxidanyl-5-[(2S,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-methyl-oxan-2-yl]oxy-oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4S,5R,6R)-4-acetyloxy-6-hexadecoxy-3-oxidanyl-5-[(2S,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-methyl-oxan-2-yl]oxy-oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5R,6R)-4-acetoxy-6-hexadecoxy-3-hydroxy-5-[(2S,3R,4R,5S,6S)-3,4,5-triacetoxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5R,6R)-4-acetyloxy-6-hexadecoxy-3-hydroxy-5-[[(2S,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-methyl-2-oxanyl]oxy]-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R,6R)-4-acetyloxy-6-hexadecoxy-3-hydroxy-5-[(2S,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5R,6R)-4-acetoxy-6-cetyloxy-3-hydroxy-5-[(2S,3R,4R,5S,6S)-3,4,5-triacetoxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]methyl ester Formula: C38H64O15 MolecularWeight: 760.90576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1C(C(C(C(O1)COC(=O)C)O)OC(=O)C)OC2C(C(C(C(O2)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C38H64O15/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-45-37-35(33(49-27(5)41)31(44)30(52-37)23-46-25(3)39)53-38-36(51-29(7)43)34(50-28(6)42)32(24(2)47-38)48-26(4)40/h24,30-38,44H,8-23H2,1-7H3/t24-,30+,31+,32-,33-,34+,35+,36+,37+,38-/m0/s1