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26,27-Dinorergost-23-ene-3,12-dione, (5.beta.)-
SpectraBase Compound ID dp4VNqpVgc
InChI InChI=1S/C26H40O2/c1-16(2)6-7-17(3)21-10-11-22-20-9-8-18-14-19(27)12-13-25(18,4)23(20)15-24(28)26(21,22)5/h6,17-18,20-23H,7-15H2,1-5H3/t17-,18-,20+,21-,22+,23+,25+,26-/m1/s1
InChIKey NOWGFZPHCTXJMF-UUUGVQEHSA-N
Mol Weight 384.6 g/mol
Molecular Formula C26H40O2
Exact Mass 384.302831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C1e7TuF2wHS
Name 26,27-Dinorergost-23-ene-3,12-dione, (5.beta.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 384.302830526 u
Formula C26H40O2
InChI InChI=1S/C26H40O2/c1-16(2)6-7-17(3)21-10-11-22-20-9-8-18-14-19(27)12-13-25(18,4)23(20)15-24(28)26(21,22)5/h6,17-18,20-23H,7-15H2,1-5H3/t17-,18-,20+,21-,22+,23+,25+,26-/m1/s1
InChIKey NOWGFZPHCTXJMF-UUUGVQEHSA-N
Molecular Weight 384.604 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@@](CC=C(C)C)(C)[H])[H])[H])C