John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=HUtOMpYngSd SpectraBase Spectrum ID=2uWQvwvDSUR

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2-O-GLUCOPYRANOSYL-CUCURBITACIN-F-25-ACETATE
SpectraBase Compound ID HUtOMpYngSd
InChI InChI=1S/C38H58O13/c1-18(40)51-33(2,3)13-12-25(42)38(9,48)30-21(41)15-35(6)24-11-10-19-20(37(24,8)26(43)16-36(30,35)7)14-22(31(47)34(19,4)5)49-32-29(46)28(45)27(44)23(17-39)50-32/h10,12-13,20-24,27-32,39,41,44-48H,11,14-17H2,1-9H3/b13-12+/t20-,21-,22+,23+,24+,27+,28-,29+,30+,31-,32+,35+,36-,37+,38?/m1/s1
InChIKey JXLGHGQDRCPDGI-DPBSHQOTSA-N
Mol Weight 722.9 g/mol
Molecular Formula C38H58O13
Exact Mass 722.387742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2uWQvwvDSUR
Name 2-O-GLUCOPYRANOSYL-CUCURBITACIN-F-25-ACETATE
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H58O13
InChI InChI=1S/C38H58O13/c1-18(40)51-33(2,3)13-12-25(42)38(9,48)30-21(41)15-35(6)24-11-10-19-20(37(24,8)26(43)16-36(30,35)7)14-22(31(47)34(19,4)5)49-32-29(46)28(45)27(44)23(17-39)50-32/h10,12-13,20-24,27-32,39,41,44-48H,11,14-17H2,1-9H3/b13-12+/t20-,21-,22+,23+,24+,27+,28-,29+,30+,31-,32+,35+,36-,37+,38?/m1/s1
InChIKey JXLGHGQDRCPDGI-DPBSHQOTSA-N
Literature Reference Author R.MATA,P.CASTANEDA,M.D.R.CAMACHO,G.DELGADO
Literature Reference Citation J.NAT.PROD.,51,836(1988)
Literature Reference DOI 10.1021/np50059a003
Molecular Weight 722.871 g/mol
Solvent PYRIDINE-D5
Source File Reference UWCS13910
SpectraBase Batch ID 7AlSa2TBrIY