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DYSOXYLIC-ACID-A;#7;(20S)-3-ALPHA-ACETOXY-7-ALPHA-HYDROXY-4,4,8-BETA-TRIMETHYL-14,18-CYCLO-5-ALPHA,13-ALPHA,14-ALPHA,17-ALPHA-CHOLEST-24Z-EN-26-OIC-ACID
SpectraBase Compound ID 2hK7m9kY63y
InChI InChI=1S/C32H50O5/c1-19(9-8-10-20(2)27(35)36)22-11-16-32-18-31(22,32)15-12-23-29(6)14-13-26(37-21(3)33)28(4,5)24(29)17-25(34)30(23,32)7/h10,19,22-26,34H,8-9,11-18H2,1-7H3,(H,35,36)/b20-10-/t19-,22-,23?,24-,25+,26+,29+,30-,31+,32+/m0/s1
InChIKey XEDSZVHPAXDXFY-WJFAWOJUSA-N
Mol Weight 514.7 g/mol
Molecular Formula C32H50O5
Exact Mass 514.365825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AJN2eC8JSVa
Name DYSOXYLIC-ACID-A;#7;(20S)-3-ALPHA-ACETOXY-7-ALPHA-HYDROXY-4,4,8-BETA-TRIMETHYL-14,18-CYCLO-5-ALPHA,13-ALPHA,14-ALPHA,17-ALPHA-CHOLEST-24Z-EN-26-OIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H50O5
InChI InChI=1S/C32H50O5/c1-19(9-8-10-20(2)27(35)36)22-11-16-32-18-31(22,32)15-12-23-29(6)14-13-26(37-21(3)33)28(4,5)24(29)17-25(34)30(23,32)7/h10,19,22-26,34H,8-9,11-18H2,1-7H3,(H,35,36)/b20-10-/t19-,22-,23?,24-,25+,26+,29+,30-,31+,32+/m0/s1
InChIKey XEDSZVHPAXDXFY-WJFAWOJUSA-N
Literature Reference Author D.A.MULHOLLAND,J.J.NAIR
Literature Reference Citation PHYTOCHEM.,37,1409(1994)
Literature Reference DOI 10.1016/S0031-9422(00)90421-7
Molecular Weight 514.746 g/mol
Solvent CD2Cl2:ACETONE-D6
Source File Reference UWMS23599