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DYSCUSIN-B;2,3-DIHYDROXY-16-OXO-PREGN-5(6)-EN
SpectraBase Compound ID J9PrYEcEYwu
InChI InChI=1S/C21H32O3/c1-4-14-17(22)10-16-13-6-5-12-9-18(23)19(24)11-21(12,3)15(13)7-8-20(14,16)2/h5,13-16,18-19,23-24H,4,6-11H2,1-3H3/t13-,14+,15+,16+,18-,19-,20-,21+/m1/s1
InChIKey YTQZNHMIWHSKRR-CRNNROHXSA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EyVrQjJqWab
Name DYSCUSIN-B;2,3-DIHYDROXY-16-OXO-PREGN-5(6)-EN
Compound Number 2
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-4-14-17(22)10-16-13-6-5-12-9-18(23)19(24)11-21(12,3)15(13)7-8-20(14,16)2/h5,13-16,18-19,23-24H,4,6-11H2,1-3H3/t13-,14+,15+,16+,18-,19-,20-,21+/m1/s1
InChIKey YTQZNHMIWHSKRR-CRNNROHXSA-N
Literature Reference Author S.I.KURIMOTO,Y.KASHIWADA,S.L.MORRIS-NATSCHKE,K.H.LEE,Y.TAKAI SHI
Literature Reference Citation CHEM.PHARM.BULL.,59,1303(2011)
Literature Reference DOI 10.1248/cpb.59.1303
Molecular Weight 332.483 g/mol
Source File Reference UWIR3659