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CERTONARDOSTEROL-L;24-METHYL-5-ALPHA-CHOLEST-22-ENE-3-BETA,4,6-ALPHA,15-BETA,26-PENTOL
SpectraBase Compound ID 2Ilb4d7k0Ub
InChI InChI=1S/C27H46O5/c1-15(9-12-28)5-6-16(2)19-14-22(31)23-17-13-21(30)24-25(32)20(29)8-11-26(24,3)18(17)7-10-27(19,23)4/h5-6,15-25,28-32H,7-14H2,1-4H3/b6-5+/t15?,16-,17-,18?,19?,20+,21+,22-,23?,24?,25?,26-,27-/m1/s1
InChIKey AKZQHZDCJDFVJI-NSDPOQGHSA-N
Mol Weight 450.7 g/mol
Molecular Formula C27H46O5
Exact Mass 450.334525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HyrhtCL1Ns9
Name CERTONARDOSTEROL-L;24-METHYL-5-ALPHA-CHOLEST-22-ENE-3-BETA,4,6-ALPHA,15-BETA,26-PENTOL
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H46O5
InChI InChI=1S/C27H46O5/c1-15(9-12-28)5-6-16(2)19-14-22(31)23-17-13-21(30)24-25(32)20(29)8-11-26(24,3)18(17)7-10-27(19,23)4/h5-6,15-25,28-32H,7-14H2,1-4H3/b6-5+/t15?,16-,17-,18?,19?,20+,21+,22-,23?,24?,25?,26-,27-/m1/s1
InChIKey AKZQHZDCJDFVJI-NSDPOQGHSA-N
Literature Reference Author W.WANG,F.LI,Y.PARK,J.HONG,C.O.LEE,J.Y.KONG,S.SHIN,K.S.IM,J.H .JUNG
Literature Reference Citation J.NAT.PROD.,66,384(2003)
Literature Reference DOI 10.1021/np020507i
Molecular Weight 450.659 g/mol
Solvent CD3OD
Source File Reference UWSI4645