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3,6-DI-O-4-METHOXYBENZYL-ALPHA-MANGOSTIN
SpectraBase Compound ID KM2KO1iDKIl
InChI InChI=1S/C40H42O6/c1-24(2)8-18-30-32(44-22-28-14-10-26(5)11-15-28)20-34-37(38(30)41)39(42)36-31(19-9-25(3)4)40(43-7)35(21-33(36)46-34)45-23-29-16-12-27(6)13-17-29/h8-17,20-21,41H,18-19,22-23H2,1-7H3
InChIKey YSVVNUNTCXIKFZ-UHFFFAOYSA-N
Mol Weight 618.8 g/mol
Molecular Formula C40H42O6
Exact Mass 618.298139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JlHFASA63If
Name 3,6-DI-O-4-METHOXYBENZYL-ALPHA-MANGOSTIN
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H42O6
InChI InChI=1S/C40H42O6/c1-24(2)8-18-30-32(44-22-28-14-10-26(5)11-15-28)20-34-37(38(30)41)39(42)36-31(19-9-25(3)4)40(43-7)35(21-33(36)46-34)45-23-29-16-12-27(6)13-17-29/h8-17,20-21,41H,18-19,22-23H2,1-7H3
InChIKey YSVVNUNTCXIKFZ-UHFFFAOYSA-N
Literature Reference Author L.D.HA,P.E.HANSEN,O.VANG,F.DUUS,H.D.PHAM,L.H.D.NGUYEN
Literature Reference Citation CHEM.PHARM.BULL.,57,830(2009)
Literature Reference DOI 10.1248/cpb.57.830
Molecular Weight 618.770 g/mol
Sample ID 2837
Solvent CDCl3