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CERTONARDOSTEROL-D;(25S)-24-METHYL-5-ALPHA-CHOLEST-24(24(1))-ENE-3-BETA,6-ALPHA,15-BETA,26-TETROL
SpectraBase Compound ID 9xjOtNrucRC
InChI InChI=1S/C28H48O4/c1-16(18(3)15-29)6-7-17(2)22-14-25(32)26-20-13-24(31)23-12-19(30)8-10-27(23,4)21(20)9-11-28(22,26)5/h17-26,29-32H,1,6-15H2,2-5H3/t17-,18+,19+,20-,21?,22?,23?,24+,25-,26?,27-,28-/m1/s1
InChIKey KZKDLDINCJUKQF-AQZKJOTBSA-N
Mol Weight 448.7 g/mol
Molecular Formula C28H48O4
Exact Mass 448.35526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IFm5cvMRR2k
Name CERTONARDOSTEROL-D;(25S)-24-METHYL-5-ALPHA-CHOLEST-24(24(1))-ENE-3-BETA,6-ALPHA,15-BETA,26-TETROL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H48O4
InChI InChI=1S/C28H48O4/c1-16(18(3)15-29)6-7-17(2)22-14-25(32)26-20-13-24(31)23-12-19(30)8-10-27(23,4)21(20)9-11-28(22,26)5/h17-26,29-32H,1,6-15H2,2-5H3/t17-,18+,19+,20-,21?,22?,23?,24+,25-,26?,27-,28-/m1/s1
InChIKey KZKDLDINCJUKQF-AQZKJOTBSA-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 448.687 g/mol
Solvent CD3OD
Source File Reference UWSI4635