| SpectraBase Compound ID | 7Aa6n17SpuI |
|---|---|
| InChI | InChI=1S/C21H33N3O7.C2HF3O2/c1-11(2)8-14(23-19(28)13(22)9-12-6-4-3-5-7-12)20(29)24-16-18(27)17(26)15(10-25)31-21(16)30;3-2(4,5)1(6)7/h3-7,11,13-18,21,25-27,30H,8-10,22H2,1-2H3,(H,23,28)(H,24,29);(H,6,7)/p-1/t13-,14-,15-,16-,17-,18-,21+;/m0./s1 |
| InChIKey | SAOUGQZTUKEIRA-DMDCWUEOSA-M |
| Mol Weight | 552.5 g/mol |
| Molecular Formula | C23H33F3N3O9 |
| Exact Mass | 552.216889 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I8BkPccWSxO |
|---|---|
| Name | 2-DEOXY-2-(L-PHENYLALANYL-L-LEUCYLAMINO)-ALPHA-D-GLUCOPYRANOSE-TRIFLUOROACETATE |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H33F3N3O9 |
| InChI | InChI=1S/C21H33N3O7.C2HF3O2/c1-11(2)8-14(23-19(28)13(22)9-12-6-4-3-5-7-12)20(29)24-16-18(27)17(26)15(10-25)31-21(16)30;3-2(4,5)1(6)7/h3-7,11,13-18,21,25-27,30H,8-10,22H2,1-2H3,(H,23,28)(H,24,29);(H,6,7)/p-1/t13-,14-,15-,16-,17-,18-,21+;/m0./s1 |
| InChIKey | SAOUGQZTUKEIRA-DMDCWUEOSA-M |
| Literature Reference Author | S.HORVAT,L.VARGA,J.HORVAT,A.PFUETZNER,H.SUHARTONO,H.RUEBSAME N-WAIGMANN |
| Literature Reference Citation | HELV.CHIM.ACTA,74,951(1991) |
| Literature Reference DOI | 10.1002/hlca.19910740505 |
| Molecular Weight | 552.525 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVP5970 |