D-myo-Inositol, 1-[(2R)-2,3-bis[(1-oxooctyl)oxy]propyl hydrogen phosphate] 4,5-bis(dihydrogen phosphate), triammonium salt

Catalog No. :
ACKQMC439
CAS No. :
852043-37-9
Molecular Formula :
C25H52NO19P3
Molecular Weight :
763.60

IUPAC Name:(2R)-3-((hydroxy(((1R,2R,3S,4R,5R,6S)-2,3,6-trihydroxy-4,5-bis(phosphonooxy)cyclohexyl)oxy)phosphoryl)oxy)propane-1,2-diyl dioctanoate, ammonia salt

D-myo-Inositol, 1-[(2R)-2,3-bis[(1-oxooctyl)oxy]propyl hydrogen phosphate] 4,5-bis(dihydrogen phosphate), triammonium salt structure diagram
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Product Information

Product NameD-myo-Inositol, 1-[(2R)-2,3-bis[(1-oxooctyl)oxy]propyl hydrogen phosphate] 4,5-bis(dihydrogen phosphate), triammonium salt
IUPAC Name(2R)-3-((hydroxy(((1R,2R,3S,4R,5R,6S)-2,3,6-trihydroxy-4,5-bis(phosphonooxy)cyclohexyl)oxy)phosphoryl)oxy)propane-1,2-diyl dioctanoate, ammonia salt
Molecular FormulaC25H52NO19P3
Molecular Weight763.60
SMILESOP(O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](OP(O)(OC[C@@H](COC(CCCCCCC)=O)OC(CCCCCCC)=O)=O)[C@H](O)[C@H]1OP(O)(O)=O)(O)=O.N
InChI KeyOFGBXUWSFCYDBS-VCBANYRLSA-N
SynonymPIP2[4',5'](8:0/8:0)
CAS No.852043-37-9
PubChem CID145710855

Synthetic Route by SureRoute

1. ACKQMC439 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACLZIR593 route compound structure diagram
    ACLZIR59373482-96-9 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACKQMC439 route product structure diagram
    ACKQMC439852043-37-9
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2. ACKQMC439 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACKQMC439 route product structure diagram
    ACKQMC439852043-37-9
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