![METHYL-2-ACETAMIDO-6-CHLORO-2,6-DIDEOXY-4-O-[2-O-(ALPHA-L-FUCOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/C5aWQRTuAxz/structure.png?h=300&w=458 "METHYL-2-ACETAMIDO-6-CHLORO-2,6-DIDEOXY-4-O-[2-O-(ALPHA-L-FUCOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | BlqVgmWnSuC |
|---|---|
| InChI | InChI=1S/C21H36ClNO14/c1-6-11(26)14(29)16(31)20(33-6)37-18-15(30)12(27)9(5-24)35-21(18)36-17-8(4-22)34-19(32-3)10(13(17)28)23-7(2)25/h6,8-21,24,26-31H,4-5H2,1-3H3,(H,23,25)/t6-,8-,9+,10-,11+,12-,13-,14+,15-,16-,17-,18+,19-,20-,21-/m0/s1 |
| InChIKey | PYUDODGKXHWACI-XYNBHAIMSA-N |
| Mol Weight | 562.0 g/mol |
| Molecular Formula | C21H36ClNO14 |
| Exact Mass | 561.182433 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C5aWQRTuAxz |
|---|---|
| Name | METHYL-2-ACETAMIDO-6-CHLORO-2,6-DIDEOXY-4-O-[2-O-(ALPHA-L-FUCOPYRANOSYL)-BETA-D-GALACTOPYRANOSYL]-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 26 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H36ClNO14 |
| InChI | InChI=1S/C21H36ClNO14/c1-6-11(26)14(29)16(31)20(33-6)37-18-15(30)12(27)9(5-24)35-21(18)36-17-8(4-22)34-19(32-3)10(13(17)28)23-7(2)25/h6,8-21,24,26-31H,4-5H2,1-3H3,(H,23,25)/t6-,8-,9+,10-,11+,12-,13-,14+,15-,16-,17-,18+,19-,20-,21-/m0/s1 |
| InChIKey | PYUDODGKXHWACI-XYNBHAIMSA-N |
| Literature Reference Author | E.PETRAKOVA,U.SPOHR,R.U.LEMIEUX |
| Literature Reference Citation | CAN.J.CHEM.,70,233(1992) |
| Literature Reference DOI | 10.1139/v92-034 |
| Molecular Weight | 561.968 g/mol |
| Solvent | D2O |
| Source File Reference | UWVP5340 |