| SpectraBase Compound ID | 3J91ghGG4v4 |
|---|---|
| InChI | InChI=1S/C21H36N2O25S3/c1-5(25)22-8-11(27)10(26)7(4-42-50(35,36)37)44-20(8)46-15-13(29)16(48-51(38,39)40)21(47-17(15)18(30)31)45-14-6(3-24)43-19(41-2)9(12(14)28)23-49(32,33)34/h6-17,19-21,23-24,26-29H,3-4H2,1-2H3,(H,22,25)(H,30,31)(H,32,33,34)(H,35,36,37)(H,38,39,40)/p-3/t6-,7+,8+,9-,10+,11+,12-,13+,14-,15+,16-,17-,19+,20+,21-/m1/s1 |
| InChIKey | ZOVREKVKHMGNOR-WRMVSFKSSA-K |
| Mol Weight | 809.7 g/mol |
| Molecular Formula | C21H33N2O25S3 |
| Exact Mass | 809.053453 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F3czMVDEW8x |
|---|---|
| Name | TRISACCHARIDE-4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H33N2O25S3 |
| InChI | InChI=1S/C21H36N2O25S3/c1-5(25)22-8-11(27)10(26)7(4-42-50(35,36)37)44-20(8)46-15-13(29)16(48-51(38,39)40)21(47-17(15)18(30)31)45-14-6(3-24)43-19(41-2)9(12(14)28)23-49(32,33)34/h6-17,19-21,23-24,26-29H,3-4H2,1-2H3,(H,22,25)(H,30,31)(H,32,33,34)(H,35,36,37)(H,38,39,40)/p-3/t6-,7+,8+,9-,10+,11+,12-,13+,14-,15+,16-,17-,19+,20+,21-/m1/s1 |
| InChIKey | ZOVREKVKHMGNOR-WRMVSFKSSA-K |
| Literature Reference Author | C.A.A.VANBOECKEL,S.F.VANAELST,G.N.WAGENAARS,J.R.MELLEMA,H.PA ULSEN,T.PETERS,A.POL |
| Literature Reference Citation | REC.TR.CH.P.-B.,106,19(1987) |
| Literature Reference DOI | 10.1002/recl.19871060102 |
| Molecular Weight | 809.671 g/mol |
| Solvent | D2O |
| Source File Reference | UWED4579 |