methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[(2R,3S,4R,5R,6R)-2-[[(2R,3R,4R,5S,6R)-5-acetyloxy-6-(acetyloxymethyl)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-[(2R,3R,4S,5S,6S)-3,4,5-triacetyloxy-6-methoxycarbonyl-oxan-2-yl]oxy-oxan-2-yl]oxymethyl]-5-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-oxidanyl-6-prop-2-enoxy-oxan-4-yl]oxy-oxane-2-carboxylate

Systemtic Name: methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[(2R,3S,4R,5R,6R)-2-[[(2R,3R,4R,5S,6R)-5-acetyloxy-6-(acetyloxymethyl)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-[(2R,3R,4S,5S,6S)-3,4,5-triacetyloxy-6-methoxycarbonyl-oxan-2-yl]oxy-oxan-2-yl]oxymethyl]-5-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-oxidanyl-6-prop-2-enoxy-oxan-4-yl]oxy-oxane-2-carboxylate Openeye Name: methyl (2S,3S,4S,5R,6R)-3,4,5-triacetoxy-6-[(2R,3S,4R,5R,6R)-2-[[(2R,3R,4R,5S,6R)-5-acetoxy-6-(acetoxymethyl)-3-(1,3-dioxoisoindolin-2-yl)-4-[(2R,3R,4S,5S,6S)-3,4,5-triacetoxy-6-methoxycarbonyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxymethyl]-6-allyloxy-5-(1,3-dioxoisoindolin-2-yl)-3-hydroxy-tetrahydropyran-4-yl]oxy-tetrahydropyran-2-carboxylate CAS Name: (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[[(2R,3S,4R,5R,6R)-2-[[(2R,3R,4R,5S,6R)-5-acetyloxy-6-(acetyloxymethyl)-3-(1,3-dioxo-2-isoindolyl)-4-[[(2R,3R,4S,5S,6S)-3,4,5-triacetyloxy-6-methoxycarbonyl-2-oxanyl]oxy]-2-oxanyl]oxymethyl]-5-(1,3-dioxo-2-isoindolyl)-3-hydroxy-6-prop-2-enoxy-4-oxanyl]oxy]-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[(2R,3S,4R,5R,6R)-2-[[(2R,3R,4R,5S,6R)-5-acetyloxy-6-(acetyloxymethyl)-3-(1,3-dioxoisoindol-2-yl)-4-[(2R,3R,4S,5S,6S)-3,4,5-triacetyloxy-6-methoxycarbonyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-5-(1,3-dioxoisoindol-2-yl)-3-hydroxy-6-prop-2-enoxyoxan-4-yl]oxyoxane-2-carboxylate Traditional Name: (2S,3S,4S,5R,6R)-3,4,5-triacetoxy-6-[(2R,3S,4R,5R,6R)-2-[[(2R,3R,4R,5S,6R)-5-acetoxy-6-(acetoxymethyl)-3-phthalimido-4-[(2R,3R,4S,5S,6S)-3,4,5-triacetoxy-6-carbomethoxy-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxymethyl]-6-allyloxy-3-hydroxy-5-phthalimido-tetrahydropyran-4-yl]oxy-tetrahydropyran-2-carboxylic acid methyl ester Formula: C61H68N2O33 MolecularWeight: 1357.18622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC=C)N3C(=O)C4=CC=CC=C4C3=O)OC5C(C(C(C(O5)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C)O)N6C(=O)C7=CC=CC=C7C6=O)OC8C(C(C(C(O8)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OCC=C)N3C(=O)C4=CC=CC=C4C3=O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C)O)N6C(=O)C7=CC=CC=C7C6=O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C61H68N2O33/c1-12-21-81-58-38(62-52(73)32-17-13-14-18-33(32)53(62)74)42(93-60-50(89-30(8)70)46(87-28(6)68)44(85-26(4)66)48(95-60)56(77)79-10)40(72)36(91-58)22-83-59-39(63-54(75)34-19-15-16-20-35(34)55(63)76)43(41(84-25(3)65)37(92-59)23-82-24(2)64)94-61-51(90-31(9)71)47(88-29(7)69)45(86-27(5)67)49(96-61)57(78)80-11/h12-20,36-51,58-61,72H,1,21-23H2,2-11H3/t36-,37-,38-,39-,40-,41-,42-,43-,44+,45+,46+,47+,48+,49+,50-,51-,58-,59-,60-,61-/m1/s1