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MEXOGENIN;(25R)-2-BETA,3-BETA-DIHYDROXY-5-BETA-SPIROSTAN-12-ONE
SpectraBase Compound ID AV4nbago1zH
InChI InChI=1S/C27H42O5/c1-14-7-8-27(31-13-14)15(2)24-22(32-27)10-19-17-6-5-16-9-20(28)21(29)12-25(16,3)18(17)11-23(30)26(19,24)4/h14-22,24,28-29H,5-13H2,1-4H3/t14-,15-,16+,17+,18-,19-,20+,21-,22-,24-,25-,26+,27+/m0/s1
InChIKey PBLXVDNSLUFVHF-WLAFHLKWSA-N
Mol Weight 446.6 g/mol
Molecular Formula C27H42O5
Exact Mass 446.303224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CtyA9oMlAr1
Name MEXOGENIN;(25R)-2-BETA,3-BETA-DIHYDROXY-5-BETA-SPIROSTAN-12-ONE
Compound Number 48
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H42O5
InChI InChI=1S/C27H42O5/c1-14-7-8-27(31-13-14)15(2)24-22(32-27)10-19-17-6-5-16-9-20(28)21(29)12-25(16,3)18(17)11-23(30)26(19,24)4/h14-22,24,28-29H,5-13H2,1-4H3/t14-,15-,16+,17+,18-,19-,20+,21-,22-,24-,25-,26+,27+/m0/s1
InChIKey PBLXVDNSLUFVHF-WLAFHLKWSA-N
Literature Reference Author P.K.AGRAWAL,D.C.JAIN,A.K.PATHAK
Literature Reference Citation MAGN.RES.CHEM.,33,923(1995)
Literature Reference DOI 10.1002/mrc.1260331202
Molecular Weight 446.627 g/mol
Solvent C5D5N
Source File Reference UWCS22136