Account (2R,3R,4R,5S,6R)-4-(decyloxy)-5-hydroxy-6-((((2R,3R,4R,5S,6R)-4-(((R)-3-methoxydecyl)oxy)-6-(methoxymethyl)-3-((Z)-octadec-11-enamido)-5-(phosphonooxy)tetrahydro-2H-pyran-2-yl)oxy)methyl)-3-(3-oxotetradecanamido)tetrahydro-2H-pyran-2-yl dihydrogen phosphate
- Catalog No. :
- ACFODV395
- CAS No. :
- 185955-34-4
- Molecular Formula :
- C66H126N2O19P2
- Molecular Weight :
- 1312.84
IUPAC Name:(2R,3S,4R,5R,6R)-6-(((2R,3S,4R,5R,6R)-4-(decyloxy)-3-hydroxy-5-(3-oxotetradecanamido)-6-(phosphonooxy)tetrahydro-2H-pyran-2-yl)methoxy)-4-(((R)-3-methoxydecyl)oxy)-2-(methoxymethyl)-5-((Z)-octadec-11-enamido)tetrahydro-2H-pyran-3-yl dihydrogen phosphate
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Product Information
| Product Name | (2R,3R,4R,5S,6R)-4-(decyloxy)-5-hydroxy-6-((((2R,3R,4R,5S,6R)-4-(((R)-3-methoxydecyl)oxy)-6-(methoxymethyl)-3-((Z)-octadec-11-enamido)-5-(phosphonooxy)tetrahydro-2H-pyran-2-yl)oxy)methyl)-3-(3-oxotetradecanamido)tetrahydro-2H-pyran-2-yl dihydrogen phosphate |
|---|---|
| IUPAC Name | (2R,3S,4R,5R,6R)-6-(((2R,3S,4R,5R,6R)-4-(decyloxy)-3-hydroxy-5-(3-oxotetradecanamido)-6-(phosphonooxy)tetrahydro-2H-pyran-2-yl)methoxy)-4-(((R)-3-methoxydecyl)oxy)-2-(methoxymethyl)-5-((Z)-octadec-11-enamido)tetrahydro-2H-pyran-3-yl dihydrogen phosphate |
| Molecular Formula | C66H126N2O19P2 |
| Molecular Weight | 1312.84 |
| SMILES | CCCCCCC[C@@H](OC)CCO[C@@H]1[C@H]([C@@H](O[C@@H]([C@H]1OP(O)(O)=O)COC)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)OP(O)(O)=O)NC(CC(CCCCCCCCCCC)=O)=O)OCCCCCCCCCC)O)NC(CCCCCCCCC/C=C\CCCCCC)=O |
| InChI Key | BPSMYQFMCXXNPC-MFCPCZTFSA-N |
| Synonym | Eritoran [inn];E5564;ERITORAN;3-O-Decyl-2-deoxy-6-O-[2-deoxy-3-O-[(3R)-3-methoxydecyl]-6-O-methyl-2-[[(11Z)-1-oxo-11-octadecenyl]amino]-4-O-phosphono-beta-D-glucopyranosyl]-2-[(1,3-dioxotetradecyl)amino]-alpha-D-glucopyranose 1-(dihydrogen phosphate);α-D-Glucopyranose, 3-O-decyl-2-deoxy-6-O-[2-deoxy-3-O-[(3R)-3-methoxydecyl]-6-O-methyl-2-[[(11Z)-1-oxo-11-octadecen-1-yl]amino]-4-O-phosphono-β-D-glucopyranosyl]-2-[(1,3-dioxotetradecyl)amino]-, 1-(dihydrogen phosphate);a-D-Glucopyranose,3-O-decyl-2-deoxy-6-O-[2-deoxy-3-O-[(3R)-3-methoxydecyl]-6-O-methyl-2-[[(11Z)-1-oxo-11-octadecen-1-yl]amino]-4-O-phosphono-b-D-glucopyranosyl]-2-[(1,3-dioxotetradecyl)amino]-,1-(dihy |
| CAS No. | 185955-34-4 |
Synthetic Route by SureRoute
2. ACFODV395 Molecular Building Block Synthetic Route
Eritoran tetrasodium
(2R,3S,4R,5R,6R)-3-Hydroxy-2-((((2R,3R,4R,5S,6R)-5-hydroxy-6-(hydroxymethyl)-3-((R)-3-hydroxytetradecanamido)-4-(((R)-3-hydroxytetradecanoyl)oxy)tetrahydro-2H-pyran-2-yl)oxy)methyl)-5-((R)-3-hydroxytetradecanamido)-6-(phosphonooxy)tetrahydro-2H-pyran-4-yl (R)-3-hydroxytetradecanoate
Kdo2-Lipid A