Products 27548-93-2
CAS 27548-93-2 appears in our catalog under these names: Baccatin iii, 95%, Paclitaxel EP Impurity N (Baccatin III), Paclitaxel Impurity 14（Paclitaxel EP Impurity N）, Baccatin III, >95% (HPLC), 13-O-De((2R,3S)-3-(benzoylamino)-2-hydroxy-3-phenylpropanoyl)paclitaxel (Baccatin III). Offered by: Combi-blocks, Chemat Brand, Hubei YoungXin, TRC, Mikromol. Available pack sizes: 250mg, 1g, 100mg, on request, 10mg, 25mg, 50mg, 200mg.
Baccatin III is a tetracyclic diterpenoid isolated from plant species of the genus Taxus. It has a role as a plant metabolite. It is a benzoate ester, an acetate ester and a tetracyclic diterpenoid. It derives from a hydride of a taxane.
Source: ChEBI
| Molecular formula | C31H38O11 |
|---|---|
| Molecular weight | 586.6 g/mol |
| IUPAC name | [(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-diacetyloxy-1,9,15-trihydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate |
| InChIKey | OVMSOCFBDVBLFW-VHLOTGQHSA-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)OC(=O)C |
Computed by PubChem (NCBI)