(5,5a,6-trihydroxy-1,1,7,9-tetramethyl-11-oxo-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-4-yl)methyl palmitate

Catalog No. :
ACCEQN352
CAS No. :
39071-33-5
Molecular Formula :
C36H58O6
Molecular Weight :
586.85

IUPAC Name:(5,5a,6-trihydroxy-1,1,7,9-tetramethyl-11-oxo-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-4-yl)methyl palmitate

(5,5a,6-trihydroxy-1,1,7,9-tetramethyl-11-oxo-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-4-yl)methyl palmitate structure diagram
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Product Information

Product Name(5,5a,6-trihydroxy-1,1,7,9-tetramethyl-11-oxo-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-4-yl)methyl palmitate
IUPAC Name(5,5a,6-trihydroxy-1,1,7,9-tetramethyl-11-oxo-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-4-yl)methyl palmitate
MDL No.MFCD31746827
Molecular FormulaC36H58O6
Molecular Weight586.85
SMILESCCCCCCCCCCCCCCCC(=O)OCC1=CC2C(=O)C3(C=C(C)C(O)C3(O)C1O)C(C)CC1C2C1(C)C
InChI KeyDSTCZBGJCUOFLM-UHFFFAOYSA-N
SynonymINGENOL-20-HEXADECANOATE;Euphorbia factor I2;Euphorbia factor L4;Ingenol-20-palmitate;PubChem ID: 101627162;Hexadecanoic acid, [(1aR,2S,5R,5aR,6S,8aS,9R,10aR)-1a,2,5,5a,6,9,10,10a-octahydro-5,5a,6-trihydroxy-1,1,7,9-tetramethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-4-yl]methyl ester;[(1S,4S,5R,6R,9R,10R,12R,14R)-4,5,6-Trihydroxy-3,11,11,14-tetramethyl-15-oxo-7-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl]met hyl hexadecanoate
CAS No.39071-33-5

Synthetic Route by SureRoute

1. ACCEQN352 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACCEQN352 route product structure diagram
    ACCEQN35239071-33-5
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2. ACCEQN352 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACKHRS769 route compound structure diagram
    ACKHRS7692601-98-1 In Stock
  4. Then
  5. ACCEQN352 route product structure diagram
    ACCEQN35239071-33-5
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