[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5R,6S)-2-methyl-6-[(2R,3R,4R,5S,6S)-6-methyl-2,4,5-tris(phenylmethoxy)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)oxan-4-yl]oxy-3,4,5-tris(phenylmethoxy)oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5R,6S)-2-methyl-6-[(2R,3R,4R,5S,6S)-6-methyl-2,4,5-tris(phenylmethoxy)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)oxan-4-yl]oxy-3,4,5-tris(phenylmethoxy)oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5R,6R)-3,4,5-tribenzyloxy-6-[(2S,3S,4R,5R,6S)-3,5-dibenzyloxy-2-methyl-6-[(2R,3R,4R,5S,6S)-2,4,5-tribenzyloxy-6-methyl-tetrahydropyran-3-yl]oxy-tetrahydropyran-4-yl]oxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5R,6R)-6-[[(2S,3S,4R,5R,6S)-2-methyl-6-[[(2R,3R,4R,5S,6S)-6-methyl-2,4,5-tris(phenylmethoxy)-3-oxanyl]oxy]-3,5-bis(phenylmethoxy)-4-oxanyl]oxy]-3,4,5-tris(phenylmethoxy)-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5R,6S)-2-methyl-6-[(2R,3R,4R,5S,6S)-6-methyl-2,4,5-tris(phenylmethoxy)oxan-3-yl]oxy-3,5-bis(phenylmethoxy)oxan-4-yl]oxy-3,4,5-tris(phenylmethoxy)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5R,6R)-3,4,5-tribenzoxy-6-[(2S,3S,4R,5R,6S)-3,5-dibenzoxy-2-methyl-6-[(2R,3R,4R,5S,6S)-2,4,5-tribenzoxy-6-methyl-tetrahydropyran-3-yl]oxy-tetrahydropyran-4-yl]oxy-tetrahydropyran-2-yl]methyl ester Formula: C76H82O15 MolecularWeight: 1235.45528

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2C(C(C(OC2OCC3=CC=CC=C3)C)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OC7C(C(C(C(O7)COC(=O)C)OCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1)OCC1=CC=CC=C1

Isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H](O[C@H]2OCC3=CC=CC=C3)C)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)O[C@@H]7[C@@H]([C@H]([C@@H]([C@H](O7)COC(=O)C)OCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1)OCC1=CC=CC=C1

InChI

InChI=1S/C76H82O15/c1-53-65(79-44-56-28-12-4-13-29-56)68(82-47-59-34-18-7-19-35-59)73(74(87-53)86-51-63-42-26-11-27-43-63)91-75-72(85-50-62-40-24-10-25-41-62)70(66(54(2)88-75)80-45-57-30-14-5-15-31-57)90-76-71(84-49-61-38-22-9-23-39-61)69(83-48-60-36-20-8-21-37-60)67(64(89-76)52-78-55(3)77)81-46-58-32-16-6-17-33-58/h4-43,53-54,64-76H,44-52H2,1-3H3/t53-,54-,64+,65-,66-,67+,68+,69-,70+,71+,72+,73+,74+,75-,76+/m0/s1