Products 32981-86-5

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

Identity
Molecular formulaC29H36O10
Molecular weight544.6 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
InChIKeyYWLXLRUDGLRYDR-ZHPRIASZSA-N
SMILESCC1=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)