Cortisone

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 332
Total Number of Articles : 977
PubChem 222786
Molecular Formula

C21H28O5

SMILES

C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C

InChI

InChI=1S/C21H28O5/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/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1

synonyms
  • cortisone
  • 53-06-5
  • Kendall's compound E
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Properties
Property Value
MW 360.4 g/mol
HBD 2
HBA 5
Rotatable Bond Count 2
Exact Mass 360.19367399 g/mol
Monoisotopic Mass 360.19367399 g/mol
Heavy Atom Count 26
Isotope Atom Count 0
Atom Stereo Count 6
Covalent Unit Count 1
Complexity 724
xlogp 1.5
Topological Polar Surface Area 91.7