(3R,10S,13R,17S)-3-azido-17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene

Systemtic Name: (3R,10S,13R,17S)-3-azido-17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene Openeye Name: (3R,10S,13R,17S)-3-azido-17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene CAS Name: (3R,10S,13R,17S)-3-azido-17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene IUPAC Name: (3R,10S,13R,17S)-3-azido-17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene Traditional Name: (3R,10S,13R,17S)-3-azido-17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene Formula: C21H35N3 MolecularWeight: 329.5227

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2C1(CCC3C2CCC4C3(CCC(C4)N=[N+]=[N-])C)C

Isomeric SMILES

CC[C@H]1CCC2[C@@]1(CCC3C2CCC4[C@@]3(CC[C@H](C4)N=[N+]=[N-])C)C

InChI

InChI=1S/C21H35N3/c1-4-14-6-8-18-17-7-5-15-13-16(23-24-22)9-11-21(15,3)19(17)10-12-20(14,18)2/h14-19H,4-13H2,1-3H3/t14-,15?,16+,17?,18?,19?,20+,21-/m0/s1