paclitaxel

CAS:
Other names:
SMILES: CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)C2[C@H](OC(=O)c4ccccc4)[C@]5(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c6ccccc6)c7ccccc7)C(=C1C5(C)C)C

Properties

MW HBA HBD LogP TPSA Rot. Comp. Fsp3C Brutto formula
853.91 15 4 4.13 221.29 13 161 0.45 C47H51NO14

Availability

Suppliers Supplier IDs Storage Storage ID Quantity Class Added
SF_C20 None Jan. 1, 2023

Bar codes

Plate barcode Sample barcode

PAINS

Identified PAINS
Not checked

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[paclitaxel] 2.53 7.0 25.0 HPLC-method Massimo Fresta 2002
[b-Cyclodextrin](1).[paclitaxel] 2.29 7.0 37.0 HPLC-method Massimo Fresta 2002
[b-Cyclodextrin](1).[paclitaxel] 1.80 7.0 45.0 HPLC-method Massimo Fresta 2002
[Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin (DS ~14) isomeric purity >50%](1).[paclitaxel] 2.61 7.0 25.0 HPLC-method Massimo Fresta 2002
[Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin (DS ~14) isomeric purity >50%](1).[paclitaxel] 2.49 7.0 37.0 HPLC-method Massimo Fresta 2002
[Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin (DS ~14) isomeric purity >50%](1).[paclitaxel] 2.43 7.0 45.0 HPLC-method Massimo Fresta 2002
[Heptakis(2,3,6-tri-O-Methyl)-b-Cyclodextrin](1).[paclitaxel] 2.55 7.0 25.0 HPLC-method Massimo Fresta 2002
[Heptakis(2,3,6-tri-O-Methyl)-b-Cyclodextrin](1).[paclitaxel] 2.35 7.0 37.0 HPLC-method Massimo Fresta 2002
[Heptakis(2,3,6-tri-O-Methyl)-b-Cyclodextrin](1).[paclitaxel] 2.01 7.0 45.0 HPLC-method Massimo Fresta 2002
Comment