3-(dimethylamino)-1-[(3S,8S,9R,10R,13R,14R,17S)-10,13-dimethyl-3,17-bis(oxidanyl)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]propan-1-one

Systemtic Name: 3-(dimethylamino)-1-[(3S,8S,9R,10R,13R,14R,17S)-10,13-dimethyl-3,17-bis(oxidanyl)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]propan-1-one Openeye Name: 1-[(3S,8S,9R,10R,13R,14R,17S)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-3-(dimethylamino)propan-1-one CAS Name: 1-[(3S,8S,9R,10R,13R,14R,17S)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-3-(dimethylamino)-1-propanone IUPAC Name: 1-[(3S,8S,9R,10R,13R,14R,17S)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-3-(dimethylamino)propan-1-one Traditional Name: 1-[(3S,8S,9R,10R,13R,14R,17S)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-3-(dimethylamino)propan-1-one Formula: C24H39NO3 MolecularWeight: 389.57136

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(CC1=CCC3C2CCC4(C3CCC4(C(=O)CCN(C)C)O)C)O

Isomeric SMILES

C[C@]12CC[C@@H](CC1=CC[C@H]3[C@H]2CC[C@@]4([C@@H]3CC[C@]4(C(=O)CCN(C)C)O)C)O

InChI

InChI=1S/C24H39NO3/c1-22-11-7-17(26)15-16(22)5-6-18-19(22)8-12-23(2)20(18)9-13-24(23,28)21(27)10-14-25(3)4/h5,17-20,26,28H,6-15H2,1-4H3/t17-,18-,19+,20+,22-,23+,24+/m0/s1