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3,6-DI-O-4-METHOXYBENZYL-ALPHA-MANGOSTIN
SpectraBase Compound ID I4vXUIxrU8n
InChI InChI=1S/C40H42O8/c1-24(2)8-18-30-32(46-22-26-10-14-28(43-5)15-11-26)20-34-37(38(30)41)39(42)36-31(19-9-25(3)4)40(45-7)35(21-33(36)48-34)47-23-27-12-16-29(44-6)17-13-27/h8-17,20-21,41H,18-19,22-23H2,1-7H3
InChIKey GTVLHYYZMORESY-UHFFFAOYSA-N
Mol Weight 650.8 g/mol
Molecular Formula C40H42O8
Exact Mass 650.287968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HUpDQAkFHcI
Name 3,6-DI-O-4-METHOXYBENZYL-ALPHA-MANGOSTIN
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H42O8
InChI InChI=1S/C40H42O8/c1-24(2)8-18-30-32(46-22-26-10-14-28(43-5)15-11-26)20-34-37(38(30)41)39(42)36-31(19-9-25(3)4)40(45-7)35(21-33(36)48-34)47-23-27-12-16-29(44-6)17-13-27/h8-17,20-21,41H,18-19,22-23H2,1-7H3
InChIKey GTVLHYYZMORESY-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 650.769 g/mol
Sample ID 2835
Solvent CDCl3