Sodium (2R,3R,4R,5R)-1,2-dihydroxy-6-oxo-4-((9-phenylnonanoyl)oxy)-5-((S)-3-((9-phenylnonanoyl)oxy)tetradecanamido)hexan-3-yl sulfate

Catalog No. :
ACJUMB034
CAS No. :
152646-95-2
Molecular Formula :
C50H78NNaO12S
Molecular Weight :
940.23

IUPAC Name:sodium (2R,3R,4R,5R)-1,2-dihydroxy-6-oxo-4-((9-phenylnonanoyl)oxy)-5-((S)-3-((9-phenylnonanoyl)oxy)tetradecanamido)hexan-3-yl sulfate

Sodium (2R,3R,4R,5R)-1,2-dihydroxy-6-oxo-4-((9-phenylnonanoyl)oxy)-5-((S)-3-((9-phenylnonanoyl)oxy)tetradecanamido)hexan-3-yl sulfate structure diagram
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Product Information

Product NameSodium (2R,3R,4R,5R)-1,2-dihydroxy-6-oxo-4-((9-phenylnonanoyl)oxy)-5-((S)-3-((9-phenylnonanoyl)oxy)tetradecanamido)hexan-3-yl sulfate
IUPAC Namesodium (2R,3R,4R,5R)-1,2-dihydroxy-6-oxo-4-((9-phenylnonanoyl)oxy)-5-((S)-3-((9-phenylnonanoyl)oxy)tetradecanamido)hexan-3-yl sulfate
Molecular FormulaC50H78NNaO12S
Molecular Weight940.23
SMILESO=S(O[C@@H]([C@H](OC(CCCCCCCCC1=CC=CC=C1)=O)[C@@H](NC(C[C@@H](OC(CCCCCCCCC2=CC=CC=C2)=O)CCCCCCCCCCC)=O)C=O)[C@H](O)CO)([O-])=O.[Na+]
InChI KeyRGYRFKPZWVWWBI-KRKOBBQYSA-M
Synonym2-Deoxy-3-O-(9-phenylnonanoyl)-2-[3(S)-(9-phenylnonanoyloxy)tetradecanamido]-4-O-sulfo-D-glucopyranose monosodium salt;Ono-4007 sodium salt;[(2R,3R,4R,5R)-1,2-dihydroxy-6-oxo-4-(9-phenylnonanoyloxy)-5-[[(3S)-3-(9-phenylnonanoyloxy)tetradecanoyl]amino]hexan-3-yl] sulfate
CAS No.152646-95-2

Synthetic Route by SureRoute

1. ACJUMB034 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACJUMB034 route product structure diagram
    ACJUMB034152646-95-2
Inquiry

2. ACJUMB034 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACJUMB034 route product structure diagram
    ACJUMB034152646-95-2
Inquiry

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