methyl (3S)-1-[[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]methyl]-3,4-dihydro-2H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: methyl (3S)-1-[[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]methyl]-3,4-dihydro-2H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: methyl (3S)-1-[[(2S,3R,4S)-5-methoxycarbonyl-2-[(2S,3R,4S,5R,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-3-vinyl-3,4-dihydro-2H-pyran-4-yl]methyl]-3,4-dihydro-2H-pyrido[3,4-b]indole-3-carboxylate CAS Name: (3S)-1-[[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxy]-3,4-dihydro-2H-pyran-4-yl]methyl]-3,4-dihydro-2H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester IUPAC Name: methyl (3S)-1-[[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]methyl]-3,4-dihydro-2H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: (3S)-1-[[(2S,3R,4S)-5-carbomethoxy-2-[(2S,3R,4S,5R,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-3-vinyl-3,4-dihydro-2H-pyran-4-yl]methyl]-3,4-dihydro-2H-$b-carboline-3-carboxylic acid methyl ester Formula: C37H42N2O15 MolecularWeight: 754.73378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC2C(C(C(=CO2)C(=O)OC)CC3=C4C(=C5C=CC=CC5=N4)CC(N3)C(=O)OC)C=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)O[C@H]2[C@@H]([C@@H](C(=CO2)C(=O)OC)CC3=C4C(=C5C=CC=CC5=N4)C[C@H](N3)C(=O)OC)C=C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C37H42N2O15/c1-8-21-23(13-27-30-24(14-28(38-27)35(45)47-7)22-11-9-10-12-26(22)39-30)25(34(44)46-6)15-49-36(21)54-37-33(52-20(5)43)32(51-19(4)42)31(50-18(3)41)29(53-37)16-48-17(2)40/h8-12,15,21,23,28-29,31-33,36-38H,1,13-14,16H2,2-7H3/t21-,23+,28+,29-,31-,32+,33-,36+,37+/m1/s1