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FOACRIIAKPYTRH-UXHICEINSA-N
SpectraBase Compound ID 6QeWTTHKTpa
InChI InChI=1S/C21H22O7/c1-11(2)8-18(24)27-19-14-9-13-6-7-17(23)25-15(13)10-16(14)26-20(19)21(4,5)28-12(3)22/h6-10,19-20H,1-5H3/t19-,20+/m1/s1
InChIKey FOACRIIAKPYTRH-UXHICEINSA-N
Mol Weight 386.4 g/mol
Molecular Formula C21H22O7
Exact Mass 386.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID hZ1VZ2d3Dn
Name 4'-ACETYL-3'-SENECIOYL-3'-HYDROXYMARMESIN
Compound Number 5 D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O7
InChI InChI=1S/C21H22O7/c1-11(2)8-18(24)27-19-14-9-13-6-7-17(23)25-15(13)10-16(14)26-20(19)21(4,5)28-12(3)22/h6-10,19-20H,1-5H3/t19-,20+/m1/s1
InChIKey FOACRIIAKPYTRH-UXHICEINSA-N
Literature Reference Author G.APPENDINO,F.BIANCHI,A.BADER,C.CAMPAGNUOLO,E.FATTORUSSO,O.T AGLIALATELA-SCAFATI,
Literature Reference Citation J.NAT.PROD.,67,532(2004)
Literature Reference DOI 10.1021/np0340652
Molecular Weight 386.401 g/mol
Solvent CDCl3
Source File Reference UWMZ7059