Responsive image

Common name


Deoxycholic Acid

IUPAC name


(4R)-4-[(1S,2S,5S,7S,10R,11S,14S,15R,16R)-5,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,

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

Compound class


Cholagogues and Choleretics;

Therapeutic area


For improvement in appearance of moderate to severe fullness associated with submental fat in adults.

Common name


Deoxycholic Acid

IUPAC name


(4R)-4-[(1S,2S,5S,7S,10R,11S,14S,15R,16R)-5,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,

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

INCHI


InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16+,17+,18+,19+,20+,21-,23+,24-/m1/s1

FORMULA


C24H40O4

Responsive image

Common name


Deoxycholic Acid

IUPAC name


(4R)-4-[(1S,2S,5S,7S,10R,11S,14S,15R,16R)-5,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,

Molecular weight


392.572

clogP


3.417

clogS


-3.131

HBond Acceptor


4

HBond Donor


3

Total Polar
Surface Area


77.76

Number of Rings


4

Rotatable Bond


4

Drug ID Common name Structure CAS SMILE Frequency
FDBF00004 acetic acid Responsive image CC(=O)O 0.0687
FDBF00007 propane Responsive image C(C)C 0.2412
FDBF00047 propionic acid Responsive image CCC(=O)O 0.0395
FDBF00062 pentanoic acid Responsive image CCCCC(=O)O 0.0079
4 , 1