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Salaspermic Acid - Methyl Ester
SpectraBase Compound ID HamOWcicPv0
InChI InChI=1S/C31H50O4/c1-20-30-10-8-21-27(4,22(30)9-11-31(20,33)35-19-30)15-17-29(6)23-18-26(3,24(32)34-7)13-12-25(23,2)14-16-28(21,29)5/h20-23,33H,8-19H2,1-7H3/t20-,21?,22?,23-,25-,26-,27-,28-,29+,30+,31+/m1/s1
InChIKey UZFRCCHTCLKPLT-BPOUMDRFSA-N
Mol Weight 486.7 g/mol
Molecular Formula C31H50O4
Exact Mass 486.37091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7QQxR2KHdxr
Name SALASPERMIC-ACID-METHYLESTER
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H50O4
InChI InChI=1S/C31H50O4/c1-20-30-10-8-21-27(4,22(30)9-11-31(20,33)35-19-30)15-17-29(6)23-18-26(3,24(32)34-7)13-12-25(23,2)14-16-28(21,29)5/h20-23,33H,8-19H2,1-7H3/t20-,21?,22?,23-,25-,26-,27-,28-,29+,30+,31+/m1/s1
InChIKey UZFRCCHTCLKPLT-BPOUMDRFSA-N
Literature Reference Author O.NGASSAPA,D.D.SOEJARTO,J.M.PEZZUTO,N.R.FARNSWORTH
Literature Reference Citation J.NAT.PROD.,57,1(1994)
Literature Reference DOI 10.1021/np50103a001
Molecular Weight 486.736 g/mol
Solvent CDCl3
Source File Reference UWCS17805