Products 75567-37-2
CAS 75567-37-2 appears in our catalog under these names: Ingenol 3-angelate, 95%, Ingenol mebutate, Ingenol 3-Angelate, >95% (HPLC), Ingenol mebutate/ 99.04% (existing batch purity), Ingenol Mebutate (Ingenol 3–angelate). Offered by: Combi-blocks, Chemat Brand, TRC, TargetMol, GLPBio. Available pack sizes: 10mg, 5mg, on request, 1mg, 2,5mg, 2mg, 25mg, 10mM (in 1ml dmso).
Ingenol mebutate is a tetracyclic diterpenoid ester obtained by formal condensation of the carboxy group of (2Z)-2-methylbut-2-enoic (angelic) acid with the 3-hydroxy group of ingenol. Used for the topical treatment of actinic keratosis. It has a role as an antineoplastic agent. It is a carboxylic ester, a cyclic terpene ketone and a tetracyclic diterpenoid. It is functionally related to an angelic acid and an ingenol.
Source: ChEBI
| Molecular formula | C25H34O6 |
|---|---|
| Molecular weight | 430.5 g/mol |
| IUPAC name | [(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] (Z)-2-methylbut-2-enoate |
| InChIKey | VDJHFHXMUKFKET-WDUFCVPESA-N |
| SMILES | C/C=C(/C)\C(=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 |
Computed by PubChem (NCBI)