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27-Norergostane, 25-ethenyl-3-methoxy-, (3.beta.,5.alpha.,24R,25R)-
SpectraBase Compound ID KnSSqmEC7Cr
InChI InChI=1S/C30H52O/c1-8-20(2)21(3)9-10-22(4)26-13-14-27-25-12-11-23-19-24(31-7)15-17-29(23,5)28(25)16-18-30(26,27)6/h8,20-28H,1,9-19H2,2-7H3/t20-,21-,22-,23+,24+,25+,26-,27+,28+,29+,30-/m1/s1
InChIKey RPOBECWHAZTCPB-FTGBGZDCSA-N
Mol Weight 428.7 g/mol
Molecular Formula C30H52O
Exact Mass 428.401816 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JxmSoyhlEK
Name 27-Norergostane, 25-ethenyl-3-methoxy-, (3.beta.,5.alpha.,24R,25R)-
CAS Registry Number 124512-50-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H52O
InChI InChI=1S/C30H52O/c1-8-20(2)21(3)9-10-22(4)26-13-14-27-25-12-11-23-19-24(31-7)15-17-29(23,5)28(25)16-18-30(26,27)6/h8,20-28H,1,9-19H2,2-7H3/t20-,21-,22-,23+,24+,25+,26-,27+,28+,29+,30-/m1/s1
InChIKey RPOBECWHAZTCPB-FTGBGZDCSA-N
Molecular Weight 428.745 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](OC)(C4)[H])C)[H])[H])(CC[C@@]1([C@@](CC[C@]([C@@](C=C)(C)[H])(C)[H])(C)[H])[H])[H])C
SPLASH splash10-004i-0064900000-1af7b6c24792c198d92a
Source of Spectrum C-112-308-7
Synonyms (1S,2S,5S,7S,10R,11S,14R,15R)-14-[(2R,5R,6R)-5,6-dimethyloct-7-en-2-yl]-5-methoxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane (24R,25R)-3.beta.-methoxy-24-methyl-26-methlene-5.alpha.cholestane
Wiley ID 1381029