2-[(8R,9S,13S,14S,16S,17S)-3-[tert-butyl(dimethyl)silyl]oxy-17-[(3S)-3-[tert-butyl(dimethyl)silyl]oxy-6-iodanyl-hexa-1,5-diynyl]-13-methyl-17-trimethylsilyloxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl]ethanal

Systemtic Name: 2-[(8R,9S,13S,14S,16S,17S)-3-[tert-butyl(dimethyl)silyl]oxy-17-[(3S)-3-[tert-butyl(dimethyl)silyl]oxy-6-iodanyl-hexa-1,5-diynyl]-13-methyl-17-trimethylsilyloxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl]ethanal Openeye Name: 2-[(8R,9S,13S,14S,16S,17S)-3-[tert-butyl(dimethyl)silyl]oxy-17-[(3S)-3-[tert-butyl(dimethyl)silyl]oxy-6-iodo-hexa-1,5-diynyl]-13-methyl-17-trimethylsilyloxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl]acetaldehyde CAS Name: 2-[(8R,9S,13S,14S,16S,17S)-3-[tert-butyl(dimethyl)silyl]oxy-17-[(3S)-3-[tert-butyl(dimethyl)silyl]oxy-6-iodohexa-1,5-diynyl]-13-methyl-17-trimethylsilyloxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl]acetaldehyde IUPAC Name: 2-[(8R,9S,13S,14S,16S,17S)-3-[tert-butyl(dimethyl)silyl]oxy-17-[(3S)-3-[tert-butyl(dimethyl)silyl]oxy-6-iodohexa-1,5-diynyl]-13-methyl-17-trimethylsilyloxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl]acetaldehyde Traditional Name: 2-[(8R,9S,13S,14S,16S,17S)-3-[tert-butyl(dimethyl)silyl]oxy-17-[(3S)-3-[tert-butyl(dimethyl)silyl]oxy-6-iodo-hexa-1,5-diynyl]-13-methyl-17-trimethylsilyloxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-16-yl]acetaldehyde Formula: C41H65IO4Si3 MolecularWeight: 833.11337

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CC(C2(C#CC(CC#CI)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C)CC=O)CCC4=C3C=CC(=C4)O[Si](C)(C)C(C)(C)C

Isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@H]([C@]2(C#C[C@H](CC#CI)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C)CC=O)CCC4=C3C=CC(=C4)O[Si](C)(C)C(C)(C)C

InChI

InChI=1S/C41H65IO4Si3/c1-38(2,3)48(11,12)44-32(16-15-26-42)21-25-41(46-47(8,9)10)31(23-27-43)29-37-36-19-17-30-28-33(45-49(13,14)39(4,5)6)18-20-34(30)35(36)22-24-40(37,41)7/h18,20,27-28,31-32,35-37H,16-17,19,22-24,29H2,1-14H3/t31-,32+,35-,36-,37+,40+,41+/m1/s1