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(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,1R)-1-methylbut-2-enyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

View entire compound with spectra: 1 MS (GC)

(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,1R)-1-methylbut-2-enyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SpectraBase Compound ID HEf77OvtruP
InChI InChI=1S/C24H38O/c1-5-6-16(2)20-9-10-21-19-8-7-17-15-18(25)11-13-23(17,3)22(19)12-14-24(20,21)4/h5-7,16,18-22,25H,8-15H2,1-4H3/b6-5+/t16-,18+,19+,20-,21+,22+,23+,24-/m1/s1
InChIKey KDARXKWNEGZJQJ-RCGJGFFKSA-N
Mol Weight 342.6 g/mol
Molecular Formula C24H38O
Exact Mass 342.292266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FdlmXueRJJh
Name (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,1R)-1-methylbut-2-enyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
CAS Registry Number 57597-08-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H38O
InChI InChI=1S/C24H38O/c1-5-6-16(2)20-9-10-21-19-8-7-17-15-18(25)11-13-23(17,3)22(19)12-14-24(20,21)4/h5-7,16,18-22,25H,8-15H2,1-4H3/b6-5+/t16-,18+,19+,20-,21+,22+,23+,24-/m1/s1
InChIKey KDARXKWNEGZJQJ-RCGJGFFKSA-N
Molecular Weight 342.567 g/mol
SMILES O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](\C=C\C)(C)[H])[H])[H])C)[H])C)[H]
SPLASH splash10-014i-9026000000-12104823b618b2b534b9
Source of Spectrum C-114-316-55
Synonyms (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(E,2R)-pent-3-en-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Wiley ID 1337065