Chemical Compound

Ingenol 3-palmitate

CAS Registry Number 52557-26-3
Ingenol 3-palmitate chemical structure
Primary Record

Ingenol 3-palmitate

In stock
5,237 g
Purity
99.7 %
CAS
52557-26-3

Compound Identifiers & Properties

CAS
52557-26-3
PubChem CID
56841025
SMILES
CCCCCCCCCCCCCCCC(=O)O[C@H]1C(=C[C@@]23[C@@]1([C@@H](C(=C[C@H](C2=O)[C@H]4[C@H](C4(C)C)C[C@H]3C)CO)O)O)C
Canonical SMILES
CCCCCCCCCCCCCCCC(=O)O[C@H]1C(C)=C[C@]23C(=O)[C@@H](C=C(CO)[C@@H](O)[C@]12O)[C@H]1[C@@H](C[C@H]3C)C1(C)C

Names & Synonyms

  • Ingenol 3-palmitate
  • Ingenol-3-palmitate
  • Ingenol3-palmitate
  • Ingenol 3-hexadecanoate
  • Ingenol-3-hexadecenoat
  • RefChem:148288
  • CHEMBL2430127
  • orb1682386
  • 52557-26-3
  • BDBM50493440
  • NP1684
  • DA-64451
  • (2-chlorophenyl)(4-ethoxyphenyl)methanone
  • J148.898H
  • [(1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-4-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] hexadecanoate
  • Hexadecanoic acid, 1a,2,5,5a,6,9,10,10a-octahydro-5,5a-dihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-11-oxo-1H-2,8a-methanocyclopenta(a)cyclopropa(e)cyclodecen-6-yl ester, (1aR-(1aalpha,2alpha,5beta,5abeta,6beta,8aalpha,9alpha,10aalpha))-
  • Hexadecanoic acid, 1a,2,5,5a,6,9,10,10a-octahydro-5,5a-dihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-11-oxo-1H-2,8a-methanocyclopenta(a)cyclopropa(e)cyclodecen-6-yl ester, (1aR-(1aalpha,2beta,5beta,5abeta,6beta,8aalpha,9alpha,10aalpha))-
  • ((1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-4-tetracyclo(7.5.1.01,5.010,12)pentadeca-2,7-dienyl) hexadecanoate
  • (1aR)-6beta-(Hexadecanoyloxy)-1aalpha,2,5,5a,6,9,10,10aalpha-octahydro-5beta,5abeta-dihydroxy-4-(hydroxymethyl)-1,1,7,9alpha-tetramethyl-1H-2beta,8aalpha-methanocyclopenta[a]cyclopropa[e]cyclodecen-11-one
  • (1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dien-4-yl hexadecanoate
  • Palmitic acid (1aR)-1a+/-,2,5,5a,6,9,10,10a+/--octahydro-5,5a-dihydroxy-4-hydroxymethyl-1,1,7,9+/--tetramethyl-11-oxo-1H-2+/-,8a+/--methanocyclopenta[a]cyclopropa[e]cyclodecen-6-yl ester