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LONGIPIN-2-ENE-7-BETA,9-ALPHA-DIOL-1-ONE-7-TIGLATE-9-ISOVALERATE
SpectraBase Compound ID DuehzJR9ZTD
InChI InChI=1S/C25H36O5/c1-9-14(4)23(28)30-17-12-18(29-19(27)10-13(2)3)25(8)20-15(5)11-16(26)21(25)22(20)24(17,6)7/h9,11,13,17-18,20-22H,10,12H2,1-8H3/b14-9+/t17-,18-,20-,21+,22-,25+/m1/s1
InChIKey SCDIIKOGQOUENK-OJLQWKSYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C25H36O5
Exact Mass 416.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1VIDrjhi8FR
Name LONGIPIN-2-ENE-7-BETA,9-ALPHA-DIOL-1-ONE-7-TIGLATE-9-ISOVALERATE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36O5
InChI InChI=1S/C25H36O5/c1-9-14(4)23(28)30-17-12-18(29-19(27)10-13(2)3)25(8)20-15(5)11-16(26)21(25)22(20)24(17,6)7/h9,11,13,17-18,20-22H,10,12H2,1-8H3/b14-9+/t17-,18-,20-,21+,22-,25+/m1/s1
InChIKey SCDIIKOGQOUENK-OJLQWKSYSA-N
Literature Reference Author D.GUERRA-RAMIREZ,C.M.CERDA-GARCIA-ROJAS,A.M.PUENTES,P.JOSEPH -NATHAN
Literature Reference Citation PHYTOCHEM.,48,151(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00793-0
Molecular Weight 416.558 g/mol
Solvent CDCl3
Source File Reference UWMS618