methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[(1S)-2-acetyloxy-1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethoxy]oxane-2-carboxylate

Systemtic Name: methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[(1S)-2-acetyloxy-1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethoxy]oxane-2-carboxylate Openeye Name: methyl (2S,3S,4S,5R,6R)-3,4,5-triacetoxy-6-[(1S)-2-acetoxy-1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-acetoxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethoxy]tetrahydropyran-2-carboxylate CAS Name: (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[(1S)-2-acetyloxy-1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethoxy]-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[(1S)-2-acetyloxy-1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethoxy]oxane-2-carboxylate Traditional Name: (2S,3S,4S,5R,6R)-3,4,5-triacetoxy-6-[(1S)-2-acetoxy-1-[(3S,5S,8R,9S,10S,13S,14S,17S)-3-acetoxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethoxy]tetrahydropyran-2-carboxylic acid methyl ester Formula: C38H56O14 MolecularWeight: 736.84284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OC(=O)C)C)C)OC5C(C(C(C(O5)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C)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

InChI

InChI=1S/C38H56O14/c1-19(39)46-18-30(51-36-34(50-23(5)43)32(49-22(4)42)31(48-21(3)41)33(52-36)35(44)45-8)29-12-11-27-26-10-9-24-17-25(47-20(2)40)13-15-37(24,6)28(26)14-16-38(27,29)7/h24-34,36H,9-18H2,1-8H3/t24-,25-,26-,27-,28-,29+,30+,31-,32-,33-,34+,36+,37-,38-/m0/s1