John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=JsB2jqCu0mH SpectraBase Spectrum ID=1JAPGy4ctDx

(accessed ).
6-O-ALPHA-D-(2,3,4,6-TETRA-O-ACETYLGLUCOPYRANOSYL)-TRIS-(ACETYLOXY)-7-METHOXYCARBONYL-5-OXO-CASUARINE
SpectraBase Compound ID JsB2jqCu0mH
InChI InChI=1S/C30H39NO19/c1-11(32)42-9-18-22(44-13(3)34)25(46-15(5)36)21-20(29(40)41-8)24(28(39)31(18)21)50-30-27(48-17(7)38)26(47-16(6)37)23(45-14(4)35)19(49-30)10-43-12(2)33/h18-27,30H,9-10H2,1-8H3/t18-,19+,20+,21-,22-,23+,24-,25-,26-,27+,30+/m1/s1
InChIKey SKXIWPUUZVANDK-RSRGFSNRSA-N
Mol Weight 717.6 g/mol
Molecular Formula C30H39NO19
Exact Mass 717.211629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1JAPGy4ctDx
Name 6-O-ALPHA-D-(2,3,4,6-TETRA-O-ACETYLGLUCOPYRANOSYL)-TRIS-(ACETYLOXY)-7-METHOXYCARBONYL-5-OXO-CASUARINE
Compound Number 10A
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H39NO19
InChI InChI=1S/C30H39NO19/c1-11(32)42-9-18-22(44-13(3)34)25(46-15(5)36)21-20(29(40)41-8)24(28(39)31(18)21)50-30-27(48-17(7)38)26(47-16(6)37)23(45-14(4)35)19(49-30)10-43-12(2)33/h18-27,30H,9-10H2,1-8H3/t18-,19+,20+,21-,22-,23+,24-,25-,26-,27+,30+/m1/s1
InChIKey SKXIWPUUZVANDK-RSRGFSNRSA-N
Literature Reference Author C.BONACCINI,M.CHIOCCIOLI,C.PARMEGGIANI,F.CARDONA,D.LORE,G.SO LDAINI,P.VOGEL,C.BEL
Literature Reference Citation EUR.J.ORG.CHEM.,2010,5574(2010)
Literature Reference DOI 10.1002/ejoc.201000632
Molecular Weight 717.635 g/mol
Solvent CDCl3
Source File Reference UWLU85972
SpectraBase Batch ID 99FuIm0gbaE