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BDA;3-OXO-BIS-NOR-CHOLA-1,4-DIEN-22-OIC-ACID
SpectraBase Compound ID JDloiEm9mHK
InChI InChI=1S/C22H30O3/c1-13(20(24)25)17-6-7-18-16-5-4-14-12-15(23)8-10-21(14,2)19(16)9-11-22(17,18)3/h8,10,12-13,16-19H,4-7,9,11H2,1-3H3,(H,24,25)/t13-,16-,17+,18-,19-,21-,22+/m0/s1
InChIKey OZESBBVMFLIODA-WAMTXRNCSA-N
Mol Weight 342.48 g/mol
Molecular Formula C22H30O3
Exact Mass 342.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 416gvIiUJxR
Name BDA;3-OXO-BIS-NOR-CHOLA-1,4-DIEN-22-OIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O3
InChI InChI=1S/C22H30O3/c1-13(20(24)25)17-6-7-18-16-5-4-14-12-15(23)8-10-21(14,2)19(16)9-11-22(17,18)3/h8,10,12-13,16-19H,4-7,9,11H2,1-3H3,(H,24,25)/t13-,16-,17+,18-,19-,21-,22+/m0/s1
InChIKey OZESBBVMFLIODA-WAMTXRNCSA-N
Literature Reference Author K.ARIMA,T.NAKAMATSU,T.BEPPU
Literature Reference Citation AGR.BIOL.CHEM.,42,411(1978)
Literature Reference DOI 10.1271/bbb1961.42.411
Molecular Weight 342.478 g/mol
Solvent CDCl3
Source File Reference UWBT8640