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27-Norergostan-3-ol, 23-methyl-, (3.beta.,5.alpha.,23R,24S)-
SpectraBase Compound ID 2I82iGX4h9V
InChI InChI=1S/C28H50O/c1-7-18(2)19(3)16-20(4)24-10-11-25-23-9-8-21-17-22(29)12-14-27(21,5)26(23)13-15-28(24,25)6/h18-26,29H,7-17H2,1-6H3/t18-,19+,20+,21-,22-,23-,24+,25-,26-,27-,28+/m0/s1
InChIKey KIZAVIVPCGOFHA-JRLLULJLSA-N
Mol Weight 402.7 g/mol
Molecular Formula C28H50O
Exact Mass 402.386166 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1HizuM1lyTC
Name 27-Norergostan-3-ol, 23-methyl-, (3.beta.,5.alpha.,23R,24S)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.386166229 u
Formula C28H50O
InChI InChI=1S/C28H50O/c1-7-18(2)19(3)16-20(4)24-10-11-25-23-9-8-21-17-22(29)12-14-27(21,5)26(23)13-15-28(24,25)6/h18-26,29H,7-17H2,1-6H3/t18-,19+,20+,21-,22-,23-,24+,25-,26-,27-,28+/m0/s1
InChIKey KIZAVIVPCGOFHA-JRLLULJLSA-N
Molecular Weight 402.707 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](O)(C4)[H])C)[H])[H])(CC[C@@]1([C@@](C[C@]([C@](CC)(C)[H])(C)[H])(C)[H])[H])[H])C