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1-BETA,6-ALPHA,15-TRIACETOXY-2-BETA,9-ALPHA-DIBENZOYLOXY-4-ALPHA-HYDROXY-DIHYDRO-BETA-AGAROFURAN
SpectraBase Compound ID 8CkMJm8Fr0v
InChI InChI=1S/C35H40O12/c1-20(36)42-19-34-27(46-31(40)24-15-11-8-12-16-24)17-25-28(43-21(2)37)35(34,47-32(25,4)5)33(6,41)18-26(29(34)44-22(3)38)45-30(39)23-13-9-7-10-14-23/h7-16,25-29,41H,17-19H2,1-6H3/t25-,26+,27+,28-,29+,33+,34-,35+/m1/s1
InChIKey ZZFJSWIPFJPKST-OCRATEHUSA-N
Mol Weight 652.7 g/mol
Molecular Formula C35H40O12
Exact Mass 652.251977 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KdzeYByJuR0
Name 1-BETA,6-ALPHA,15-TRIACETOXY-2-BETA,9-ALPHA-DIBENZOYLOXY-4-ALPHA-HYDROXY-DIHYDRO-BETA-AGAROFURAN
Compound Number 5
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H40O12
InChI InChI=1S/C35H40O12/c1-20(36)42-19-34-27(46-31(40)24-15-11-8-12-16-24)17-25-28(43-21(2)37)35(34,47-32(25,4)5)33(6,41)18-26(29(34)44-22(3)38)45-30(39)23-13-9-7-10-14-23/h7-16,25-29,41H,17-19H2,1-6H3/t25-,26+,27+,28-,29+,33+,34-,35+/m1/s1
InChIKey ZZFJSWIPFJPKST-OCRATEHUSA-N
Literature Reference Author J.HOHMANN,G.NAGY,Z.DINI,G.GUENTHER,I.PELCZER,G.JERKOVICH
Literature Reference Citation J.NAT.PROD.,58,1192(1995)
Literature Reference DOI 10.1021/np50122a006
Molecular Weight 652.695 g/mol
Solvent CDCl3
Source File Reference UWPR217