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24-METHYLENE-27-METHYLCHOLESTANE-3-BETA,5-ALPHA,6-BETA-TRIOL
SpectraBase Compound ID Ix6wZns4ZQd
InChI InChI=1S/C29H50O3/c1-7-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18,20-26,30-32H,3,7-17H2,1-2,4-6H3/t18-,20-,21+,22+,23-,24+,25+,26-,27-,28-,29+/m1/s1
InChIKey HISZBVWOYRUGHP-CCXVSYILSA-N
Mol Weight 446.7 g/mol
Molecular Formula C29H50O3
Exact Mass 446.375995 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JTMerUQDrRL
Name 24-METHYLENE-27-METHYLCHOLESTANE-3-BETA,5-ALPHA,6-BETA-TRIOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H50O3
InChI InChI=1S/C29H50O3/c1-7-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(31)29(32)17-21(30)12-15-28(29,6)25(22)13-14-27(23,24)5/h18,20-26,30-32H,3,7-17H2,1-2,4-6H3/t18-,20-,21+,22+,23-,24+,25+,26-,27-,28-,29+/m1/s1
InChIKey HISZBVWOYRUGHP-CCXVSYILSA-N
Literature Reference Author H.W.LIN,Z.L.WANG,J.H.WU,N.SHI,H.J.ZHANG,W.S.CHEN,S.L.MORRIS- NATSCHKE,A.S.LIN
Literature Reference Citation J.NAT.PROD.,70,1114(2007)
Literature Reference DOI 10.1021/np070069l
Molecular Weight 446.714 g/mol
Sample ID 30696
Solvent CDCl3