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CERTONARDOSTEROL-Q7;(24S)-3-BETA,4-BETA,6-ALPHA,24-TETRAHYDROXY-5-ALPHA-CHOLEST-8(14)-EN-15-ONE
SpectraBase Compound ID 9mJFSuojy62
InChI InChI=1S/C27H44O5/c1-14(2)19(28)7-6-15(3)18-13-22(31)23-16-12-21(30)24-25(32)20(29)9-11-26(24,4)17(16)8-10-27(18,23)5/h14-15,17-21,24-25,28-30,32H,6-13H2,1-5H3/t15-,17?,18?,19-,20+,21+,24?,25+,26-,27-/m1/s1
InChIKey GBPZDYRTHBIZMU-BEYXDKBYSA-N
Mol Weight 448.6 g/mol
Molecular Formula C27H44O5
Exact Mass 448.318875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Df9Zmt27R2H
Name CERTONARDOSTEROL-Q7;(24S)-3-BETA,4-BETA,6-ALPHA,24-TETRAHYDROXY-5-ALPHA-CHOLEST-8(14)-EN-15-ONE
Compound Number 7
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44O5
InChI InChI=1S/C27H44O5/c1-14(2)19(28)7-6-15(3)18-13-22(31)23-16-12-21(30)24-25(32)20(29)9-11-26(24,4)17(16)8-10-27(18,23)5/h14-15,17-21,24-25,28-30,32H,6-13H2,1-5H3/t15-,17?,18?,19-,20+,21+,24?,25+,26-,27-/m1/s1
InChIKey GBPZDYRTHBIZMU-BEYXDKBYSA-N
Literature Reference Author W.WANG,H.JANG,J.HONG,C.O.LEE,K.S.IM,S.J.BAE,J.H.JUNG
Literature Reference Citation J.NAT.PROD.,67,1654(2004)
Literature Reference DOI 10.1021/np049869b
Molecular Weight 448.643 g/mol
Solvent CD3OD
Source File Reference UWMZ6508