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3-O-(2',3',4'-TRIACETOXY-6'-O-PALMITOYL-BETA-D-GLUCOPYRANOSYL)-CAMPESTEROL
SpectraBase Compound ID L1yg07e44RN
InChI InChI=1S/C56H94O10/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-24-50(60)61-36-49-51(62-40(6)57)52(63-41(7)58)53(64-42(8)59)54(66-49)65-44-31-33-55(9)43(35-44)27-28-45-47-30-29-46(56(47,10)34-32-48(45)55)39(5)26-25-38(4)37(2)3/h27,37-39,44-49,51-54H,11-26,28-36H2,1-10H3/t38-,39+,44-,45-,46+,47-,48-,49+,51+,52-,53+,54+,55-,56+/m0/s1
InChIKey FIRWAPWKARFKNA-ZAXWCEIRSA-N
Mol Weight 927.4 g/mol
Molecular Formula C56H94O10
Exact Mass 926.684699 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9YUuBkJmEgp
Name 3-O-(2',3',4'-TRIACETOXY-6'-O-PALMITOYL-BETA-D-GLUCOPYRANOSYL)-CAMPESTEROL
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H94O10
InChI InChI=1S/C56H94O10/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-24-50(60)61-36-49-51(62-40(6)57)52(63-41(7)58)53(64-42(8)59)54(66-49)65-44-31-33-55(9)43(35-44)27-28-45-47-30-29-46(56(47,10)34-32-48(45)55)39(5)26-25-38(4)37(2)3/h27,37-39,44-49,51-54H,11-26,28-36H2,1-10H3/t38-,39+,44-,45-,46+,47-,48-,49+,51+,52-,53+,54+,55-,56+/m0/s1
InChIKey FIRWAPWKARFKNA-ZAXWCEIRSA-N
Literature Reference Author R.SALINAS,J.ARELLANO-GARCIA,I.PEREA-ARANGO,L.ALVAREZ,M.L.GAR DUNO-RAMIREZ
Literature Reference Citation MOLECULES,19,8679(2014)
Literature Reference DOI 10.3390/molecules19068679
Molecular Weight 927.356 g/mol
Solvent CDCl3
Source File Reference UWIR14817