Chemical Compound

Ingenol 3,20-dibenzoate

CAS Registry Number 59086-90-7
Back to search Request a Quote
Ingenol 3,20-dibenzoate chemical structure
Primary Record

Ingenol 3,20-dibenzoate

In stock
5,073 g
Purity
98.6 %
CAS
59086-90-7

Compound Identifiers & Properties

CAS
59086-90-7
PubChem CID
46173778
SMILES
C[C@@H]1C[C@@H]2[C@@H](C2(C)C)[C@H]3C=C([C@H]([C@]4([C@@]1(C3=O)C=C([C@@H]4OC(=O)C5=CC=CC=C5)C)O)O)COC(=O)C6=CC=CC=C6
Canonical SMILES
CC1=C[C@]23C(=O)[C@H](C=C(COC(=O)c4ccccc4)[C@@H](O)[C@]2(O)[C@H]1OC(=O)c1ccccc1)[C@H]1[C@@H](C[C@H]3C)C1(C)C

Names & Synonyms

  • Ingenol 3,20-dibenzoate
  • INGENOL3,20-DIBENZOATE
  • DTXSID301313972
  • EX-A11189
  • EBC-618383
  • MS-30143
  • HY-137295
  • CS-0137590
  • G17824
  • 59086-90-7
  • [(1S,4S,5S,6R,9R,10R,12R,14R)-4-(benzoyloxy)-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0^{1,5}.0^{10,12}]pentadeca-2,7-dien-7-yl]methyl benzoate
  • [(1S,4S,5S,6R,9R,10R,12R,14R)-4-benzoyloxy-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxo-7-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl]methyl benzoate
  • [(2R,5R,5aS,6S,8aS,9R)-6-(Benzoyloxy)-5,5a-dihydroxy-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 benzoate