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METHYL-DIACETYLPINFAENSATE;METHYL-2-ALPHA,3-BETA-DIACETOXY-23-FORMYL-19-ALPHA-TRIHYDROXY-URS-12-EN-28-OATE
SpectraBase Compound ID 1NcNtykoJr8
InChI InChI=1S/C35H52O8/c1-20-12-15-35(29(39)41-9)17-16-32(6)23(27(35)34(20,8)40)10-11-26-30(4)18-24(42-21(2)37)28(43-22(3)38)31(5,19-36)25(30)13-14-33(26,32)7/h10,19-20,24-28,40H,11-18H2,1-9H3/t20-,24+,25+,26+,27+,28-,30-,31-,32+,33+,34+,35-/m0/s1
InChIKey RYPOTPDROJURQD-PFBFOJGNSA-N
Mol Weight 600.8 g/mol
Molecular Formula C35H52O8
Exact Mass 600.366219 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GBn6mhk7Sp6
Name METHYL-DIACETYLPINFAENSATE;METHYL-2-ALPHA,3-BETA-DIACETOXY-23-FORMYL-19-ALPHA-TRIHYDROXY-URS-12-EN-28-OATE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H52O8
InChI InChI=1S/C35H52O8/c1-20-12-15-35(29(39)41-9)17-16-32(6)23(27(35)34(20,8)40)10-11-26-30(4)18-24(42-21(2)37)28(43-22(3)38)31(5,19-36)25(30)13-14-33(26,32)7/h10,19-20,24-28,40H,11-18H2,1-9H3/t20-,24+,25+,26+,27+,28-,30-,31-,32+,33+,34+,35-/m0/s1
InChIKey RYPOTPDROJURQD-PFBFOJGNSA-N
Literature Reference Author D.G.DURHAM,X.LIU,R.M.E.RICHARDS
Literature Reference Citation PHYTOCHEM.,36,1469(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89744-7
Molecular Weight 600.793 g/mol
Solvent C5D5N
Source File Reference UWLU26420