Dodecanamide, N-[(1S,2R,3E)-1-[[(3,6-di-O-sulfo-β-D-galactopyranosyl)oxy]methyl]-2-hydroxy-3-heptadecen-1-yl]-, ammonium salt (1:2)

Catalog No. :
ACKPUY618
CAS No. :
852043-40-4
Molecular Formula :
C36H72N2O14S2
Molecular Weight :
821.11

IUPAC Name:((2R,3S,4S,5R,6R)-6-(((2S,3R,E)-2-dodecanamido-3-hydroxyoctadec-4-en-1-yl)oxy)-3,5-dihydroxy-4-(sulfooxy)tetrahydro-2H-pyran-2-yl)methyl hydrogen sulfate, ammonia salt

Dodecanamide, N-[(1S,2R,3E)-1-[[(3,6-di-O-sulfo-β-D-galactopyranosyl)oxy]methyl]-2-hydroxy-3-heptadecen-1-yl]-, ammonium salt (1:2) structure diagram
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Product Information

Product NameDodecanamide, N-[(1S,2R,3E)-1-[[(3,6-di-O-sulfo-β-D-galactopyranosyl)oxy]methyl]-2-hydroxy-3-heptadecen-1-yl]-, ammonium salt (1:2)
IUPAC Name((2R,3S,4S,5R,6R)-6-(((2S,3R,E)-2-dodecanamido-3-hydroxyoctadec-4-en-1-yl)oxy)-3,5-dihydroxy-4-(sulfooxy)tetrahydro-2H-pyran-2-yl)methyl hydrogen sulfate, ammonia salt
Molecular FormulaC36H72N2O14S2
Molecular Weight821.11
SMILESOS(OC[C@@H](O1)[C@H](O)[C@H](OS(O)(=O)=O)[C@@H](O)[C@@H]1OC[C@@H]([C@@H](/C=C/CCCCCCCCCCCCC)O)NC(CCCCCCCCCCC)=O)(=O)=O.N
InChI KeyHQCDCNPESYEJGX-CIEWKKQXSA-N
Synonym852043-40-4 | DTXSID70677061 | Bisammonium (2S,3R,4E)-2-(dodecanoylamino)-3-hydroxyoctadec-4-en-1-yl 3,6-di-O-sulfonato-alpha-L-glycero-hexopyranoside
CAS No.852043-40-4
PubChem CID46891758

Synthetic Route by SureRoute

1. ACKPUY618 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. ACKPUY618 route product structure diagram
    ACKPUY618852043-40-4
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2. ACKPUY618 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. ACKPUY618 route product structure diagram
    ACKPUY618852043-40-4
Inquiry

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