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METHYL-PINFAENOATE;2-ALPHA,3-BETA,23-TRIHYDROXY-URSA-12,18-DIEN-28-O-METHYLESTER
SpectraBase Compound ID FoJov3Vnr15
InChI InChI=1S/C31H48O5/c1-18-10-13-31(26(35)36-7)15-14-29(5)20(24(31)19(18)2)8-9-23-27(3)16-21(33)25(34)28(4,17-32)22(27)11-12-30(23,29)6/h8,18,21-23,25,32-34H,9-17H2,1-7H3/t18-,21-,22?,23?,25+,27+,28+,29-,30-,31+/m1/s1
InChIKey QPHZXJGOLPWYTM-STWVGJOXSA-N
Mol Weight 500.7 g/mol
Molecular Formula C31H48O5
Exact Mass 500.350175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtI94wSRp2E
Name METHYL-PINFAENOATE;2-ALPHA,3-BETA,23-TRIHYDROXY-URSA-12,18-DIEN-28-O-METHYLESTER
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H48O5
InChI InChI=1S/C31H48O5/c1-18-10-13-31(26(35)36-7)15-14-29(5)20(24(31)19(18)2)8-9-23-27(3)16-21(33)25(34)28(4,17-32)22(27)11-12-30(23,29)6/h8,18,21-23,25,32-34H,9-17H2,1-7H3/t18-,21-,22?,23?,25+,27+,28+,29-,30-,31+/m1/s1
InChIKey QPHZXJGOLPWYTM-STWVGJOXSA-N
Literature Reference Author D.G.DURHAM,I.X.LIU,R.M.E.RICHARDS
Literature Reference Citation PHYTOCHEM.,42,505(1996)
Literature Reference DOI 10.1016/0031-9422(96)00016-7
Molecular Weight 500.719 g/mol
Solvent CDCl3