cyclopentane; (8S,9S,13S,14S)-17-cyclopentyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-ol; iron(2+)

Systemtic Name: cyclopentane; (8S,9S,13S,14S)-17-cyclopentyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-ol; iron(2+) Openeye Name: ferrous; cyclopentane; (8S,9S,13S,14S)-17-cyclopentyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-ol CAS Name: cyclopentane; (8S,9S,13S,14S)-17-cyclopentyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-ol; iron(2+) IUPAC Name: cyclopentane; (8S,9S,13S,14S)-17-cyclopentyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-ol; iron(2+) Traditional Name: ferrous; cyclopentane; (8S,9S,13S,14S)-17-cyclopentyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-ol Formula: C28H30FeO+2 MolecularWeight: 438.3822

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CC=C2[C]4[CH][CH][CH][CH]4)CCC5=C3C=CC(=C5)O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC=C2[C]4[CH][CH][CH][CH]4)CCC5=C3C=CC(=C5)O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C23H25O.C5H5.Fe/c1-23-13-12-19-18-9-7-17(24)14-16(18)6-8-20(19)22(23)11-10-21(23)15-4-2-3-5-15;1-2-4-5-3-1;/h2-5,7,9-10,14,19-20,22,24H,6,8,11-13H2,1H3;1-5H;/q;;+2/t19-,20-,22+,23-;;/m1../s1