Prednisone

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 570
Total Number of Articles : 1411
PubChem 5865
Molecular Formula

C21H26O5

SMILES

C[C@]12CC(=O)[C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)CCC4=CC(=O)C=C[C@]34C

InChI

InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1

synonyms
  • prednisone
  • 53-03-2
  • Dehydrocortisone
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Properties
Property Value
MW 358.4 g/mol
HBD 2
HBA 5
Rotatable Bond Count 2
Exact Mass 358.17802393 g/mol
Monoisotopic Mass 358.17802393 g/mol
Heavy Atom Count 26
Isotope Atom Count 0
Atom Stereo Count 6
Covalent Unit Count 1
Complexity 764
xlogp 1.5
Topological Polar Surface Area 91.7