| SpectraBase Compound ID | 3fZZ4MwdkJu |
|---|---|
| InChI | InChI=1S/C36H60FN3O25/c1-9(46)38-17-24(53)20(49)13(5-42)58-33(17)62-28-16(8-45)61-35(19(40-11(3)48)30(28)64-36-27(56)25(54)21(50)14(6-43)60-36)63-29-18(39-10(2)47)34(59-15(7-44)23(29)52)65-31-26(55)22(51)12(4-41)57-32(31)37/h12-36,41-45,49-56H,4-8H2,1-3H3,(H,38,46)(H,39,47)(H,40,48)/t12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25+,26+,27-,28+,29-,30-,31-,32-,33-,34+,35-,36+/m1/s1 |
| InChIKey | KVVMIPLQBZQKQP-KYWSTIAZSA-N |
| Mol Weight | 953.9 g/mol |
| Molecular Formula | C36H60FN3O25 |
| Exact Mass | 953.349993 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 56XJVF9pAfG |
|---|---|
| Name | OLIGOSACCHARIDE (FROM YERSINIA ALDOVAE) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C36H60FN3O25 |
| InChI | InChI=1S/C36H60FN3O25/c1-9(46)38-17-24(53)20(49)13(5-42)58-33(17)62-28-16(8-45)61-35(19(40-11(3)48)30(28)64-36-27(56)25(54)21(50)14(6-43)60-36)63-29-18(39-10(2)47)34(59-15(7-44)23(29)52)65-31-26(55)22(51)12(4-41)57-32(31)37/h12-36,41-45,49-56H,4-8H2,1-3H3,(H,38,46)(H,39,47)(H,40,48)/t12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25+,26+,27-,28+,29-,30-,31-,32-,33-,34+,35-,36+/m1/s1 |
| InChIKey | KVVMIPLQBZQKQP-KYWSTIAZSA-N |
| Instrument Name | Bruker HX-360 |
| Literature Reference | V.A.ZUBKOV, R.P.GORSHKOVA, E.L.NAZARENKO, A.S.SHASHKOV, YU.S.OVODOV (1991)Bioorganich.Khim.(Russ. Lang.): v.17, N6, 831-838. |
| NMR Standard | CCl3F |
| Observed nucleus | 19F |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O deuterium oxide |