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METHYL-1-BETA,2-BETA,3-BETA,19-ALPHA-TETRAHYDROXY-URS-12-EN-28-OATE
SpectraBase Compound ID ArLJHrC0c0h
InChI InChI=1S/C31H50O6/c1-17-11-14-31(25(35)37-8)16-15-27(4)18(22(31)30(17,7)36)9-10-20-28(27,5)13-12-19-26(2,3)23(33)21(32)24(34)29(19,20)6/h9,17,19-24,32-34,36H,10-16H2,1-8H3/t17-,19+,20+,21-,22-,23+,24-,27-,28-,29+,30-,31+/m1/s1
InChIKey QIENFPGBPQGUPZ-XUDNDUCCSA-N
Mol Weight 518.7 g/mol
Molecular Formula C31H50O6
Exact Mass 518.360739 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CVqmhE6EbyC
Name METHYL-1-BETA,2-BETA,3-BETA,19-ALPHA-TETRAHYDROXY-URS-12-EN-28-OATE
Compound Number 237
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H50O6
InChI InChI=1S/C31H50O6/c1-17-11-14-31(25(35)37-8)16-15-27(4)18(22(31)30(17,7)36)9-10-20-28(27,5)13-12-19-26(2,3)23(33)21(32)24(34)29(19,20)6/h9,17,19-24,32-34,36H,10-16H2,1-8H3/t17-,19+,20+,21-,22-,23+,24-,27-,28-,29+,30-,31+/m1/s1
InChIKey QIENFPGBPQGUPZ-XUDNDUCCSA-N
Literature Reference Author S.B.MAHATO,A.P.KUNDU
Literature Reference Citation PHYTOCHEM.,37,1517(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89569-2
Molecular Weight 518.734 g/mol
Solvent CDCl3
Source File Reference UWMS5337