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O',O',O',O'-TETRAACETYLISOHISTELOSAMIDE
SpectraBase Compound ID FimSANU1d06
InChI InChI=1S/C29H35N3O12/c1-6-17-18-9-21-23-20(30-12-31-23)7-8-32(21)27(37)19(18)10-39-28(17)44-29-26(42-16(5)36)25(41-15(4)35)24(40-14(3)34)22(43-29)11-38-13(2)33/h6,10,12,17-18,21-22,24-26,28-29H,1,7-9,11H2,2-5H3,(H,30,31)/t17-,18+,21+,22+,24+,25-,26+,28+,29-/m1/s1
InChIKey PQVBIQARAKYZNJ-AGJHTRIESA-N
Mol Weight 617.6 g/mol
Molecular Formula C29H35N3O12
Exact Mass 617.222074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1GOyR1VXD86
Name O',O',O',O'-TETRAACETYLISOHISTELOSAMIDE
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H35N3O12
InChI InChI=1S/C29H35N3O12/c1-6-17-18-9-21-23-20(30-12-31-23)7-8-32(21)27(37)19(18)10-39-28(17)44-29-26(42-16(5)36)25(41-15(4)35)24(40-14(3)34)22(43-29)11-38-13(2)33/h6,10,12,17-18,21-22,24-26,28-29H,1,7-9,11H2,2-5H3,(H,30,31)/t17-,18+,21+,22+,24+,25-,26+,28+,29-/m1/s1
InChIKey PQVBIQARAKYZNJ-AGJHTRIESA-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 617.610 g/mol
Solvent C6D6
Source File Reference UWSI4143