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24-Methylcholestane-3.beta.,5.alpha.,6.beta.,25-tetraol-25-monoacetate
SpectraBase Compound ID C6cajZtqjHK
InChI InChI=1S/C30H52O5/c1-18(8-9-19(2)27(4,5)35-20(3)31)23-10-11-24-22-16-26(33)30(34)17-21(32)12-15-29(30,7)25(22)13-14-28(23,24)6/h18-19,21-26,32-34H,8-17H2,1-7H3/t18-,19?,21+,22+,23?,24+,25+,26-,28-,29-,30+/m1/s1
InChIKey NTYRSMDNACWFJE-HKPAJBMVSA-N
Mol Weight 492.7 g/mol
Molecular Formula C30H52O5
Exact Mass 492.381475 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CykcQxumpE2
Name 24-METHYL-CHOLESTANE-3-BETA,5-ALPHA,6-BETA,25-TETRAOL-25-MONOACETATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H52O5
InChI InChI=1S/C30H52O5/c1-18(8-9-19(2)27(4,5)35-20(3)31)23-10-11-24-22-16-26(33)30(34)17-21(32)12-15-29(30,7)25(22)13-14-28(23,24)6/h18-19,21-26,32-34H,8-17H2,1-7H3/t18-,19?,21+,22+,23?,24+,25+,26-,28-,29-,30+/m1/s1
InChIKey NTYRSMDNACWFJE-HKPAJBMVSA-N
Literature Reference Author H.DONG,Y.L.GOU,R.M.KINI,H.X.XU,S.X.CHEN,S.L.M.TEO,P.P.H.BUT
Literature Reference Citation CHEM.PHARM.BULL.,48,1087(2000)
Literature Reference DOI 10.1248/cpb.48.1087
Molecular Weight 492.740 g/mol
Solvent CDCl3
Source File Reference UWVN4409