(8S,9R,10S,13S,14S,17S)-17-ethanoyl-13-[3-[4-[(E)-hydroxyiminomethyl]phenyl]propyl]-10-methyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

Systemtic Name: (8S,9R,10S,13S,14S,17S)-17-ethanoyl-13-[3-[4-[(E)-hydroxyiminomethyl]phenyl]propyl]-10-methyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Openeye Name: (1E)-4-[3-[(8S,9R,10S,13S,14S,17S)-17-acetyl-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-13-yl]propyl]benzaldehyde oxime CAS Name: (1E)-4-[3-[(8S,9R,10S,13S,14S,17S)-17-acetyl-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-13-yl]propyl]benzaldehyde oxime IUPAC Name: (8S,9R,10S,13S,14S,17S)-17-acetyl-13-[3-[4-[(E)-hydroxyiminomethyl]phenyl]propyl]-10-methyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Traditional Name: (1E)-4-[3-[(8S,9R,10S,13S,14S,17S)-17-acetyl-3-keto-10-methyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-13-yl]propyl]benzaldoxime Formula: C30H39NO3 MolecularWeight: 461.63556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)CCCC5=CC=C(C=C5)C=NO

Isomeric SMILES

CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@@H]3[C@H]2CCC4=CC(=O)CC[C@@]34C)CCCC5=CC=C(C=C5)/C=N/O

InChI

InChI=1S/C30H39NO3/c1-20(32)26-11-12-28-25-10-9-23-18-24(33)13-16-29(23,2)27(25)14-17-30(26,28)15-3-4-21-5-7-22(8-6-21)19-31-34/h5-8,18-19,25-28,34H,3-4,9-17H2,1-2H3/b31-19+/t25-,26-,27-,28+,29-,30-/m1/s1