acetic acid [(2R,3R,4R,5R,6S)-3-[[(2S,4aR,6S,7R,8R,8aS)-7-acetamido-8-(tert-butyl-dimethyl-silyl)oxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[5,6-d][1,3]dioxin-6-yl]oxy]-5-acetamido-2-(benzyloxymethyl)-6-(ethylthio)tetrahydropyran-4-yl] ester
Compound with spectra: 1 NMR
![acetic acid [(2R,3R,4R,5R,6S)-3-[[(2S,4aR,6S,7R,8R,8aS)-7-acetamido-8-(tert-butyl-dimethyl-silyl)oxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[5,6-d][1,3]dioxin-6-yl]oxy]-5-acetamido-2-(benzyloxymethyl)-6-(ethylthio)tetrahydropyran-4-yl] ester](/api/compound/9IU8NcXNapx.png?ph=true&h=300&w=458 "acetic acid [(2R,3R,4R,5R,6S)-3-[[(2S,4aR,6S,7R,8R,8aS)-7-acetamido-8-(tert-butyl-dimethyl-silyl)oxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[5,6-d][1,3]dioxin-6-yl]oxy]-5-acetamido-2-(benzyloxymethyl)-6-(ethylthio)tetrahydropyran-4-yl] ester")
| SpectraBase Compound ID | 9IU8NcXNapx |
|---|---|
| InChI | InChI=1S/C40H58N2O11SSi/c1-10-54-39-32(42-25(3)44)35(48-26(4)45)33(29(50-39)22-46-21-27-17-13-11-14-18-27)52-38-31(41-24(2)43)36(53-55(8,9)40(5,6)7)34-30(49-38)23-47-37(51-34)28-19-15-12-16-20-28/h11-20,29-39H,10,21-23H2,1-9H3,(H,41,43)(H,42,44)/t29-,30-,31-,32-,33+,34+,35-,36-,37+,38+,39+/m1/s1 |
| InChIKey | VLVTYNYMEZZKCQ-INHVJFQRSA-N |
| Mol Weight | 803.1 g/mol |
| Molecular Formula | C40H58N2O11SSi |
| Exact Mass | 802.353058 g/mol |
| Enantiomer InChIKey | VLVTYNYMEZZKCQ-WBBUCGNZSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
#12;TRIETHYLAMMONIUM-2-ACETAMIDO-4,6-O-BENZYLIDENE-3-O-(TERT.-BUTYLDIMETHYLSILYL)-2-DEOXY-BETA-D-GALACTOPYRANOSYL-(1->4)-2-ACETAMIDO-3-O-ACETYL-6-O-BENZ
VUWWAMFSRZJTLW-CFIXQSSVSA-N
#7;ALLYL-3,6-DI-O-BENZOYL-4-O-(2-O-BENZOYL-4,6-DI-O-BENZYLIDENE-3-O-CHLOROACETYL-BETA-D-GALACTOPYRANOSYL)-2-DEOXY-2-ACETAMIDO-BETA-D-GLUCOPYRANOSIDE
#32;2-(4-AMINOCYCLOHEXYL)-ETHYL-2-ACETAMIDO-2-DEOXY-BETA-D-GALACTOPYRANOSYL-(1->4)-2-ACETAMIDO-3-O-ACETYL-2-DEOXY-ALPHA-D-GALACTOPYRANOSYL-PHOSPHATE-(1->3)-2-A
#30;2-(4-AMINOCYCLOHEXYL)-ETHYL-2-ACETAMIDO-2-DEOXY-BETA-D-GALACTOPYRANOSYL-(1->4)-2-ACETAMIDO-3-O-ACETYL-2-DEOXY-ALPHA-D-GALACTOPYRANOSYL-PHOSPHATE-(1-
#32;6-BENZYLTHIOHEXYL-2-ACETAMIDO-4-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-6-O-BENZYL-3-O-(2,3,4-TRI-O-BENZYL-ALPHA-L-FUCOPYRANOSYL)-2-DEOXY-BETA-D
#30;6-AZIDOHEXYL-2-ACETAMIDO-4-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-6-O-BENZYL-3-O-(2,3,4-TRI-O-BENZYL-ALPHA-L-FUCOPYRANOSYL)-2-DEOXY-BETA-D-GLUC
#31;6-ACETYLTHIOHEXYL-2-ACETAMIDO-4-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-6-O-BENZYL-3-O-(2,3,4-TRI-O-BENZYL-ALPHA-L-FUCOPYRANOSYL)-2-DEOXY-BETA-D
METHYL-DIMETHYLTHEXYLSILYL-4-O-(2-ACETAMIDO-3-O-BENZYL-4,6-O-BENZYLIDENE-2-DEOXY-ALPHA-D-GLUCOPYRANOSYL)-3-O-BENZYL-BETA-L-IDOPYRANURONATE
#10;ALLYL-3,6-DI-O-BENZOYL-4-O-(2-O-BENZOYL-4,6-DI-O-BENZYLIDENE-3-DEOXY-3-AZIDE-BETA-D-GALACTOPYRANOSYL)-2-DEOXY-2-ACETAMIDO-BETA-D-GLUCOPYRANOSIDE
| Title | Journal or Book | Year |
|---|---|---|
| Syntheses of Anomerically Phosphodiester-Linked Oligomers of the Repeating Units of the Haemophilus influenzae Types c and f Capsular Polysaccharides | The Journal of Organic Chemistry | 2001 |