| SpectraBase Compound ID | LAg0Lu5bNMR |
|---|---|
| InChI | InChI=1S/C31H53N3O20/c1-11(38)5-19(43)34-20(26-21(32-13(3)39)16(42)6-31(54-26,30(47)48)49-10-15(41)7-35)12(2)50-28-22(33-14(4)40)27(24(45)18(9-37)51-28)53-29-25(46)23(44)17(8-36)52-29/h11-12,15-18,20-29,35-38,41-42,44-46H,5-10H2,1-4H3,(H,32,39)(H,33,40)(H,34,43)(H,47,48)/t11-,12+,15?,16-,17-,18+,20+,21-,22+,23-,24+,25+,26-,27+,28-,29-,31+/m0/s1 |
| InChIKey | HMUFNFNKCDWABJ-OSUNOULQSA-N |
| Mol Weight | 787.8 g/mol |
| Molecular Formula | C31H53N3O20 |
| Exact Mass | 787.322241 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GoJRdS9NS9N |
|---|---|
| Name | TRISACCHARIDE 2 (FROM SHIGELLA BOYDII) |
| Comments | 1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H53N3O20 |
| InChI | InChI=1S/C31H53N3O20/c1-11(38)5-19(43)34-20(26-21(32-13(3)39)16(42)6-31(54-26,30(47)48)49-10-15(41)7-35)12(2)50-28-22(33-14(4)40)27(24(45)18(9-37)51-28)53-29-25(46)23(44)17(8-36)52-29/h11-12,15-18,20-29,35-38,41-42,44-46H,5-10H2,1-4H3,(H,32,39)(H,33,40)(H,34,43)(H,47,48)/t11-,12+,15?,16-,17-,18+,20+,21-,22+,23-,24+,25+,26-,27+,28-,29-,31+/m0/s1 |
| InChIKey | HMUFNFNKCDWABJ-OSUNOULQSA-N |
| Instrument Name | Bruker WM-250 |
| Literature Reference | V.L.L'VOV, A.S.SHASHKOV, B.A.DMITRIEV (1987) Bioorganich.Khim.(Russ. Lang.):v.13, N2, 223-233. |
| NMR Standard | CH3OH |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |