ethyl 2-[(3S,8R,9S,10R,13S,14S)-17-acetamido-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-16-yl]-2H-oxete-4-carboxylate

Systemtic Name: ethyl 2-[(3S,8R,9S,10R,13S,14S)-17-acetamido-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-16-yl]-2H-oxete-4-carboxylate Openeye Name: ethyl 2-[(3S,8R,9S,10R,13S,14S)-17-acetamido-3-acetoxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-16-yl]-2H-oxete-4-carboxylate CAS Name: 2-[(3S,8R,9S,10R,13S,14S)-17-acetamido-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-16-yl]-2H-oxete-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3S,8R,9S,10R,13S,14S)-17-acetamido-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-16-yl]-2H-oxete-4-carboxylate Traditional Name: 2-[(3S,8R,9S,10R,13S,14S)-17-acetamido-3-acetoxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-16-yl]-2H-oxete-4-carboxylic acid ethyl ester Formula: C29H39NO6 MolecularWeight: 497.62306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(O1)C2=C(C3(CCC4C(C3C2)CC=C5C4(CCC(C5)OC(=O)C)C)C)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(O1)C2=C([C@]3(CC[C@H]4[C@H]([C@@H]3C2)CC=C5[C@@]4(CC[C@@H](C5)OC(=O)C)C)C)NC(=O)C

InChI

InChI=1S/C29H39NO6/c1-6-34-27(33)25-15-24(36-25)21-14-23-20-8-7-18-13-19(35-17(3)32)9-11-28(18,4)22(20)10-12-29(23,5)26(21)30-16(2)31/h7,15,19-20,22-24H,6,8-14H2,1-5H3,(H,30,31)/t19-,20+,22-,23-,24?,28-,29-/m0/s1