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Androstan-17-one, 3,5,14-trihydroxy-, (3.beta.,5.alpha.,14.beta.)-
SpectraBase Compound ID 67Y8FFLUiee
InChI InChI=1S/C19H30O4/c1-16-7-3-12(20)11-18(16,22)9-5-14-13(16)4-8-17(2)15(21)6-10-19(14,17)23/h12-14,20,22-23H,3-11H2,1-2H3
InChIKey JXZDAHHXAAJSBS-UHFFFAOYSA-N
Mol Weight 322.44 g/mol
Molecular Formula C19H30O4
Exact Mass 322.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FkgAHlDBtsn
Name Androstan-17-one, 3,5,14-trihydroxy-, (3.beta.,5.alpha.,14.beta.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.214409442 u
Formula C19H30O4
InChI InChI=1S/C19H30O4/c1-16-7-3-12(20)11-18(16,22)9-5-14-13(16)4-8-17(2)15(21)6-10-19(14,17)23/h12-14,20,22-23H,3-11H2,1-2H3
InChIKey JXZDAHHXAAJSBS-UHFFFAOYSA-N
Molecular Weight 322.445 g/mol
SMILES C[C@]12[C@@]3([C@]([C@]4(O)[C@@](CC3)(C)C(=O)CC4)(CC[C@@]2(O)C[C@](CC1)(O)[H])[H])[H]