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[(1S,4aS,4bR,7S,8S,10R,10aS)-8,10-diacetoxy-1,4a,7-trimethyl-7-vinyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthren-1-yl]methyl acetate

View entire compound with spectra: 1 MS (GC)

[(1S,4aS,4bR,7S,8S,10R,10aS)-8,10-diacetoxy-1,4a,7-trimethyl-7-vinyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthren-1-yl]methyl acetate
SpectraBase Compound ID Ghsl0D9zOuS
InChI InChI=1S/C26H38O6/c1-8-24(5)13-10-20-19(23(24)32-18(4)29)14-21(31-17(3)28)22-25(6,15-30-16(2)27)11-9-12-26(20,22)7/h8,14,20-23H,1,9-13,15H2,2-7H3/t20-,21+,22+,23+,24+,25+,26-/m0/s1
InChIKey UPQGTQJWQQHUCX-KIPWCGLGSA-N
Mol Weight 446.6 g/mol
Molecular Formula C26H38O6
Exact Mass 446.266839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xzwsmlYLGO
Name [(1S,4aS,4bR,7S,8S,10R,10aS)-8,10-diacetoxy-1,4a,7-trimethyl-7-vinyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthren-1-yl]methyl acetate
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Formula C26H38O6
InChI InChI=1S/C26H38O6/c1-8-24(5)13-10-20-19(23(24)32-18(4)29)14-21(31-17(3)28)22-25(6,15-30-16(2)27)11-9-12-26(20,22)7/h8,14,20-23H,1,9-13,15H2,2-7H3/t20-,21+,22+,23+,24+,25+,26-/m0/s1
InChIKey UPQGTQJWQQHUCX-KIPWCGLGSA-N
Instrument Name Micromass Autospec
Ionization Type EI
Literature Reference DOI 10.1021/np020457h
Molecular Weight 446.584 g/mol
Reported Formula C26H38O6
SMILES C1C[C@@](COC(=O)C)(C)[C@]2([C@@](C=C3[C@]([C@](C)(C=C)CC[C@]3([H])[C@]2(C)C1)(OC(C)=O)[H])(OC(C)=O)[H])[H]
SPLASH splash10-0uem-0493000000-eb9ac253c72d08734ba7
Source of Spectrum G4-66-396-9a
Wiley ID 1881298