CAS 32981-86-5 appears in our catalog under these names: 10–DAB (10–Deacetylbaccatin), Docetaxel EP Impurity E (10-Deacetyl Baccatin III), 10-Deacetyl Baccatin III, 10-Deacetyl Baccatin III, >95% (HPLC), 10-O-Deacetylbaccatin III. Offered by: GLPBio, Chemat Brand, TRC, Mikromol, TargetMol. Available pack sizes: 5mg, on request, 100mg, 50mg, 4x25mg, 25mg, 10mM (in 1ml dmso), 5g.
10-deacetylbaccatin III is a secondary alpha-hydroxy ketone and a tetracyclic diterpenoid. It is functionally related to a baccatin III.
Source: ChEBI
| Molecular formula | C29H36O10 |
|---|---|
| Molecular weight | 544.6 g/mol |
| IUPAC name | [(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetyloxy-1,9,12,15-tetrahydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate |
| InChIKey | YWLXLRUDGLRYDR-ZHPRIASZSA-N |
| SMILES | CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O |
Computed by PubChem (NCBI)