Dodec-2-trans-enoyl-CoA

Catalog No. :
ACWZRE689
CAS No. :
1066-12-2
Molecular Formula :
C33H56N7O17P3S
Molecular Weight :
947.83

IUPAC Name:S-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) (E)-dodec-2-enethioate

Dodec-2-trans-enoyl-CoA structure diagram
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Product Information

Product NameDodec-2-trans-enoyl-CoA
IUPAC NameS-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) (E)-dodec-2-enethioate
Molecular FormulaC33H56N7O17P3S
Molecular Weight947.83
SMILESO[C@H]1[C@](O[C@@H]([C@H]1OP(O)(O)=O)COP(OP(OCC(C)(C)[C@@H](O)C(NCCC(NCCSC(/C=C/CCCCCCCCC)=O)=O)=O)(O)=O)(O)=O)([H])N2C3=NC=NC(N)=C3N=C2
InChI KeyIRFYVBULXZMEDE-DEEZISNZSA-N
SynonymDTXSID90331456 | S-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-Aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] dodec-2-enethioate | CTK4A4669
CAS No.1066-12-2
PubChem CID439947

Synthetic Route by SureRoute

1. ACWZRE689 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACHSVD831 route compound structure diagram
    ACHSVD83118439-24-2 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACWZRE689 route product structure diagram
    ACWZRE6891066-12-2
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2. ACWZRE689 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. ACWZRE689 route product structure diagram
    ACWZRE6891066-12-2
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