Kdo2-Lipid A

Catalog No. :
ACQHXZ941
CAS No. :
123621-04-5
Molecular Formula :
C110H202N2O39P2
Molecular Weight :
2238.75

IUPAC Name:(2R,4R,5R,6R)-2-(((2R,4R,5R,6R)-2-carboxy-6-((R)-1,2-dihydroxyethyl)-2-(((2R,3S,4R,5R,6R)-5-((R)-3-(dodecanoyloxy)tetradecanamido)-6-(((2R,3S,4R,5R,6R)-3-hydroxy-5-((R)-3-hydroxytetradecanamido)-4-(((R)-3-hydroxytetradecanoyl)oxy)-6-(phosphonooxy)tetrahydro-2H-pyran-2-yl)methoxy)-3-(phosphonooxy)-4-(((R)-3-(tetradecanoyloxy)tetradecanoyl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)-5-hydroxytetrahydro-2H-pyran-4-yl)oxy)-6-((R)-1,2-dihydroxyethyl)-4,5-dihydroxytetrahydro-2H-pyran-2-carboxylic acid

Kdo2-Lipid A structure diagram
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Product Information

Product NameKdo2-Lipid A
IUPAC Name(2R,4R,5R,6R)-2-(((2R,4R,5R,6R)-2-carboxy-6-((R)-1,2-dihydroxyethyl)-2-(((2R,3S,4R,5R,6R)-5-((R)-3-(dodecanoyloxy)tetradecanamido)-6-(((2R,3S,4R,5R,6R)-3-hydroxy-5-((R)-3-hydroxytetradecanamido)-4-(((R)-3-hydroxytetradecanoyl)oxy)-6-(phosphonooxy)tetrahydro-2H-pyran-2-yl)methoxy)-3-(phosphonooxy)-4-(((R)-3-(tetradecanoyloxy)tetradecanoyl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)-5-hydroxytetrahydro-2H-pyran-4-yl)oxy)-6-((R)-1,2-dihydroxyethyl)-4,5-dihydroxytetrahydro-2H-pyran-2-carboxylic acid
Molecular FormulaC110H202N2O39P2
Molecular Weight2238.75
SMILESCCCCCCCCCCCCCC(O[C@H](CCCCCCCCCCC)CC(O[C@@H]1[C@H]([C@@H](O[C@@H]([C@H]1OP(O)(O)=O)CO[C@@]2(C[C@H]([C@H]([C@@](O2)([H])[C@H](O)CO)O)O[C@]3(O[C@]([C@@H]([C@@H](C3)O)O)([H])[C@H](O)CO)C(O)=O)C(O)=O)OC[C@@H]4[C@H]([C@@H]([C@H]([C@H](O4)OP(O)(O)=O)NC(C[C@H](O)CCCCCCCCCCC)=O)OC(C[C@H](O)CCCCCCCCCCC)=O)O)NC(C[C@@H](CCCCCCCCCCC)OC(CCCCCCCCCCC)=O)=O)=O)=O
InChI KeyDIXUKJUHGLIZGU-OIPVZEHTSA-N
SynonymKdo2-Lipid A (ready-to-use);α-D-Glucopyranose, O-3-deoxy-α-D-manno-2-octulopyranosonosyl-(2→4)-O-3-deoxy-α-D-manno-2-octulopyranosonosyl-(2→6)-O-2-deoxy-2-[[(3R)-1-oxo-3-[(1-oxododecyl)oxy]tetradecyl]amino]-3-O-[(3R)-1-oxo-3-[(1-oxotetradecyl)oxy]tetradecyl]-4-O-phosphono-β-D-glucopyranosyl-(1→6)-2-deoxy-2-[[(3R)-3-hydroxy-1-o...
CAS No.123621-04-5

Synthetic Route by SureRoute

1. ACQHXZ941 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACQHXZ941 route product structure diagram
    ACQHXZ941123621-04-5
Inquiry

2. ACQHXZ941 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACQHXZ941 route product structure diagram
    ACQHXZ941123621-04-5
Inquiry

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