3a,12a-dihydroxy-5b-cholanoic acid

CAS:
Other names: deoxycholate, DCA
SMILES: C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C

Properties

MW HBA HBD LogP TPSA Rot. Comp. Fsp3C Brutto formula
392.57 4 3 4.48 77.76 4 21 0.96 C24H40O4

Availability

Suppliers Supplier IDs Storage Storage ID Quantity Class Added
VR_C35 None Jan. 1, 2023

Bar codes

Plate barcode Sample barcode

PAINS

Identified PAINS
Not checked

Supramolecules

Namelog KSDpHT(°C)MethodRef
[Randomly methylated-b-Cyclodextrin (DS ~12)](1).[3a,12a-dihydroxy-5b-cholanoic acid] 3.80 2.21 25.0 Isothermal Titration Calorimetry Fredrik Ollila 2001
Comment