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23a-Bromo-3b,12b-dihydroxy-(25R)-5a-spirostan-11-one

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23a-Bromo-3b,12b-dihydroxy-(25R)-5a-spirostan-11-one
SpectraBase Compound ID IUmqwPVSd7O
InChI InChI=1S/C27H41BrO5/c1-13-9-20(28)27(32-12-13)14(2)21-19(33-27)11-18-17-6-5-15-10-16(29)7-8-25(15,3)22(17)23(30)24(31)26(18,21)4/h13-22,24,29,31H,5-12H2,1-4H3
InChIKey MJCUKEIDOQBABA-UHFFFAOYSA-N
Mol Weight 525.5 g/mol
Molecular Formula C27H41BrO5
Exact Mass 524.213737 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HCCTtqJmQsS
Name 23a-Bromo-3b,12b-dihydroxy-(25R)-5a-spirostan-11-one
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H41BrO5
InChI InChI=1S/C27H41BrO5/c1-13-9-20(28)27(32-12-13)14(2)21-19(33-27)11-18-17-6-5-15-10-16(29)7-8-25(15,3)22(17)23(30)24(31)26(18,21)4/h13-22,24,29,31H,5-12H2,1-4H3
InChIKey MJCUKEIDOQBABA-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference J.A. Garcia, H.T. Castro, Magn. Res. Chem. 25, 831 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3