Account (2R,3R,4R,5R)-2,5,6-trihydroxy-4-(((2S,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)hexanal
- Catalog No. :
- ACEIRB654
- CAS No. :
- 72468-43-0
- Molecular Formula :
- C30H52O24
- Molecular Weight :
- 796.72
IUPAC Name:(2R,3R,4R,5R)-2,5,6-trihydroxy-4-(((2S,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)hexanal
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Product Information
| Product Name | (2R,3R,4R,5R)-2,5,6-trihydroxy-4-(((2S,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)hexanal |
|---|---|
| IUPAC Name | (2R,3R,4R,5R)-2,5,6-trihydroxy-4-(((2S,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)hexanal |
| Molecular Formula | C30H52O24 |
| Molecular Weight | 796.72 |
| SMILES | C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@@H]([C@H](O[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](O)C=O)[C@H](O)CO)O[C@H](CO)[C@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O |
| InChI Key | CCFRNRFHYCCXAY-DJJJHDQLSA-N |
| Synonym | ALPHA-FUC-[1->2][ALPHA-GAL-(1->3)]-BETA-GAL-[1->4][ALPHA-FUC-(1->3)]-GLC;II2FUC,I3FUC-IGBOSE3;B-PENTA;B-PENTASACCHARIDE;B-pentasaccharide from human urine;α-fuc-(1→2)(α-gal-[1→3])-β-gal-(1→4)(α-fuc-[1→3])-glc;BloodGroupBPentasaccharide;(2S,3S,4R,5S,6S)-2-[(3R,4R,5R,6R)-2,3-dihydroxy-5-[(2S,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-6-(hydroxymethyl)oxan-4-yl]oxy-6-methyloxane-3,4,5-triol |
| CAS No. | 72468-43-0 |
Synthetic Route by SureRoute
2. ACEIRB654 Molecular Building Block Synthetic Route
(2S,3S,4R,5R)-6-(((2S,3S,4S,5R,6R)-3,5-dihydroxy-4-(((2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-6-((((2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-2,4,5-trihydroxy-3-(((2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)hexanal
(2R,3S,4S,5R)-3-(((2R,3R,4R,5R,6R)-5-(((2S,3R,4S,5S,6R)-3,5-Dihydroxy-6-(hydroxymethyl)-4-(((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-
(2R,3S,4S,5R)-3-(((1S,3S,4S,5S,8R)-8-(((2S,3R,4S,5S,6R)-4-(((1S,3S,4S,5S,8R)-8-(((2S,3R,4S,5S,6R)-4-(((1S,3S,4S,5S,8R)-8-(((2S,3R,4S,5S,6R)-4-(((1S,3S,4S,5R,8R)-4,8-dihydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl)oxy)-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl)oxy)-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl)oxy)-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl)oxy)-2,4,5,6-tetrahydroxyhexanal