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26,27-Dinorergostane-3,12-dione, 24-hydroxy-, (5.beta.)-
SpectraBase Compound ID CrajhWgSf0I
InChI InChI=1S/C26H42O3/c1-16(10-12-24(2,3)29)20-8-9-21-19-7-6-17-14-18(27)11-13-25(17,4)22(19)15-23(28)26(20,21)5/h16-17,19-22,29H,6-15H2,1-5H3/t16-,17-,19+,20-,21+,22+,25+,26-/m1/s1
InChIKey MZGJYKZHNFDJGV-JIWOSGGESA-N
Mol Weight 402.6 g/mol
Molecular Formula C26H42O3
Exact Mass 402.313395 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FHl2cZjfkFy
Name 26,27-Dinorergostane-3,12-dione, 24-hydroxy-, (5.beta.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.313395209 u
Formula C26H42O3
InChI InChI=1S/C26H42O3/c1-16(10-12-24(2,3)29)20-8-9-21-19-7-6-17-14-18(27)11-13-25(17,4)22(19)15-23(28)26(20,21)5/h16-17,19-22,29H,6-15H2,1-5H3/t16-,17-,19+,20-,21+,22+,25+,26-/m1/s1
InChIKey MZGJYKZHNFDJGV-JIWOSGGESA-N
Molecular Weight 402.619 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@]4([C@@]([C@]3(CC2=O)[H])(CCC(=O)C4)C)[H])[H])(CC[C@@]1([C@@](CCC(O)(C)C)(C)[H])[H])[H])C