2-Methylthioadenosine diphosphate (sodium salt)

Catalog No. :
ACACHF169
CAS No. :
475193-31-8
Molecular Formula :
C11H14N5Na3O9P2S
Molecular Weight :
523.24

IUPAC Name:sodium (2S,3S,4R,5R)-5-(6-amino-2-methyl-9H-purin-9-yl)-4-hydroxy-2-(mercaptomethyl)tetrahydrofuran-3-yl diphosphate

2-Methylthioadenosine diphosphate (sodium salt) structure diagram
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Product Information

Product Name2-Methylthioadenosine diphosphate (sodium salt)
IUPAC Namesodium (2S,3S,4R,5R)-5-(6-amino-2-methyl-9H-purin-9-yl)-4-hydroxy-2-(mercaptomethyl)tetrahydrofuran-3-yl diphosphate
Molecular FormulaC11H14N5Na3O9P2S
Molecular Weight523.24
SMILESCC1=NC2=C(N=CN2[C@@H]2O[C@H](CS)[C@@H](OP(=O)([O-])OP(=O)([O-])[O-])[C@H]2O)C(N)=N1.[Na+].[Na+].[Na+]
InChI KeyYZZFOJOWTQNBDH-MTQUBGKESA-K
Synonym2-Mes-ADP | 2-Methylthioadenosine diphosphate trisodium | 2-methylthio-ADP | 2-Methylthio-ADP trisodium | 2-(methylthio)-adenosine 5'-(trihydrogen diphosphate), trisodium salt | 2MeSADP | 2-MeSADP | 2-methylthio ADP
CAS No.475193-31-8
PubChem CID52942441

Synthetic Route by SureRoute

1. ACACHF169 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACACHF169 route product structure diagram
    ACACHF169475193-31-8
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2. ACACHF169 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACBFSC511 route compound structure diagram
    ACBFSC51143086-58-4
  4. Then
  5. ACACHF169 route product structure diagram
    ACACHF169475193-31-8
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