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3beta-Hydroxy-16-cyclohexylmethylen-delta5-androsten-17-one
SpectraBase Compound ID FUEeS4HkN9C
InChI InChI=1S/C26H38O2/c1-25-12-10-20(27)16-19(25)8-9-21-22(25)11-13-26(2)23(21)15-18(24(26)28)14-17-6-4-3-5-7-17/h8,14,17,20-23,27H,3-7,9-13,15-16H2,1-2H3/t20-,21+,22-,23-,25-,26-/m0/s1
InChIKey YIDFOCUBJRIXOB-MUJSDITESA-N
Mol Weight 382.6 g/mol
Molecular Formula C26H38O2
Exact Mass 382.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H0S4JOzwmWo
Name 3beta-Hydroxy-16-cyclohexylmethylen-delta5-androsten-17-one
Alternate Name(s) (3S,8R,9S,10R,13S,14S)-16-(cyclohexylmethylene)-3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38O2
InChI InChI=1S/C26H38O2/c1-25-12-10-20(27)16-19(25)8-9-21-22(25)11-13-26(2)23(21)15-18(24(26)28)14-17-6-4-3-5-7-17/h8,14,17,20-23,27H,3-7,9-13,15-16H2,1-2H3/t20-,21+,22-,23-,25-,26-/m0/s1
InChIKey YIDFOCUBJRIXOB-MUJSDITESA-N
Molecular Weight 382.588 g/mol
SMILES O[C@@]1(CC=2[C@](CC1)([C@@]1([C@@](CC2)([C@]2([C@](CC1)(C(C(C2)=CC1CCCCC1)=O)C)[H])[H])[H])C)[H]
SPLASH splash10-001i-0039000000-e2cb891c9d9db6f76a30
Source of Spectrum K-101-2336-15
Wiley ID 1793346