2393-58-0

Name (3a,5b,6b,7a)-3,6,7-trihydroxy-Cholan-24-oic acid
CAS 2393-58-0
Molecular Formula C24H40O5
MDL Number MFCD00271402
Molecular Weight 408.58
MOL File 2393-58-0.mol

Chemical Properties

Melting point  200-202 °C
Boiling point  565.7±40.0 °C(Predicted)
density  1.184±0.06 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 4.76±0.10(Predicted)
color  White to Off-White
InChIKey DKPMWHFRUGMUKF-GDYCBZMLSA-N
SMILES [H][C@@]12[C@]([C@](CC[C@@H](O)C3)(C)[C@]3([H])[C@H](O)[C@H]2O)([H])CC[C@@]4(C)[C@@]1([H])CC[C@]4([H])[C@]([H])(C)CCC(O)=O

Safety Data

WGK Germany  WGK 3
HS Code  2937900090
Storage Class 11 - Combustible Solids

Hazard Information

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