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(5R,7R,8R,9S,10S,13R,14S,17R)-17-[(2R)-butan-2-yl]-10,13-dimethyl-7-oxidanyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one

View entire compound with spectra: 1 MS (GC)

(5R,7R,8R,9S,10S,13R,14S,17R)-17-[(2R)-butan-2-yl]-10,13-dimethyl-7-oxidanyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
SpectraBase Compound ID HHEpVHmBlQ3
InChI InChI=1S/C23H38O2/c1-5-14(2)17-6-7-18-21-19(9-11-23(17,18)4)22(3)10-8-16(24)12-15(22)13-20(21)25/h14-15,17-21,25H,5-13H2,1-4H3/t14-,15+,17-,18+,19+,20-,21+,22+,23-/m1/s1
InChIKey DFKAMCSTBFKMOH-CAMSTRJTSA-N
Mol Weight 346.6 g/mol
Molecular Formula C23H38O2
Exact Mass 346.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bz5YIzWdxym
Name (5R,7R,8R,9S,10S,13R,14S,17R)-17-[(2R)-butan-2-yl]-10,13-dimethyl-7-oxidanyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
Alternate Name(s) (5R,7R,8R,9S,10S,13R,14S,17R)-17-[(2R)-butan-2-yl]-7-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one (5R,7R,8R,9S,10S,13R,14S,17R)-7-hydroxy-10,13-dimethyl-17-[(1R)-1-methylpropyl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
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Formula C23H38O2
InChI InChI=1S/C23H38O2/c1-5-14(2)17-6-7-18-21-19(9-11-23(17,18)4)22(3)10-8-16(24)12-15(22)13-20(21)25/h14-15,17-21,25H,5-13H2,1-4H3/t14-,15+,17-,18+,19+,20-,21+,22+,23-/m1/s1
InChIKey DFKAMCSTBFKMOH-CAMSTRJTSA-N
Molecular Weight 346.555 g/mol
SMILES O[C@]1([C@]2([C@]3([C@@]([C@](CC3)([C@@](CC)(C)[H])[H])(CC[C@@]2([C@@]2([C@](CC(CC2)=O)([H])C1)C)[H])C)[H])[H])[H]
SPLASH splash10-004i-0019000000-965547880c21d988e0fa
Source of Spectrum KC-0-1956-14
Wiley ID 784156