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O',O',O',O'-TETRAACETYL-HISTELOSIDE
SpectraBase Compound ID KhJ9ZnRmjOq
InChI InChI=1S/C30H39N3O13/c1-7-18-19(10-22-24-21(8-9-31-22)32-13-33-24)20(28(38)39-6)11-41-29(18)46-30-27(44-17(5)37)26(43-16(4)36)25(42-15(3)35)23(45-30)12-40-14(2)34/h7,11,13,18-19,22-23,25-27,29-31H,1,8-10,12H2,2-6H3,(H,32,33)/t18-,19+,22+,23-,25-,26+,27-,29+,30+/m1/s1
InChIKey LQRQDYWNPIJOHF-RIVNUJBESA-N
Mol Weight 649.6 g/mol
Molecular Formula C30H39N3O13
Exact Mass 649.248288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4AgnmeYHvdJ
Name O',O',O',O'-TETRAACETYL-HISTELOSIDE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H39N3O13
InChI InChI=1S/C30H39N3O13/c1-7-18-19(10-22-24-21(8-9-31-22)32-13-33-24)20(28(38)39-6)11-41-29(18)46-30-27(44-17(5)37)26(43-16(4)36)25(42-15(3)35)23(45-30)12-40-14(2)34/h7,11,13,18-19,22-23,25-27,29-31H,1,8-10,12H2,2-6H3,(H,32,33)/t18-,19+,22+,23-,25-,26+,27-,29+,30+/m1/s1
InChIKey LQRQDYWNPIJOHF-RIVNUJBESA-N
Literature Reference Author G.BEKE,L.F.SZABO,B.PODANYI
Literature Reference Citation J.NAT.PROD.,65,649(2002)
Literature Reference DOI 10.1021/np010415d
Molecular Weight 649.652 g/mol
Solvent CDCl3
Source File Reference UWSI4140