Structure Database (LMSD)

Common Name
corticosterone
Systematic Name
11β,21-dihydroxypregn-4-ene-3,20-dione
Synonyms
  • (11beta)-11,21-dihydroxypregn-4-ene-3,20-dione
  • 11beta,21-Dihydroxy-4-pregnene-3,20-dione
  • 11beta,21-dihydroxyprogesterone
  • 17-deoxycortisol
  • CORTICOSTERONE
  • Corticosterone
  • Kendall's compound B
  • Reichstein's substance H
  • corticosterone
LM ID
LMST02030186
Status
Active
Exact Mass
Calculate m/z
346.21441
Formula
Abbrev




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MDLMOL SDF CSV TSV
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Main

Classification

String Representations

InChiKey (Click to copy)
OMFXVFTZEKFJBZ-HJTSIMOOSA-N
InChi (Click to copy)
InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-17,19,22,24H,3-8,10-11H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1
SMILES (Click to copy)
C1CC2[C@]([C@@]3([H])[C@@H](O)C[C@@]4(C)[C@@]([H])(CC[C@@]4(C(=O)CO)[H])[C@]13[H])(C)CCC(=O)C=2

References

Other Databases

Wikipedia
KEGG ID
HMDB ID
CHEBI ID
PubChem CID
SwissLipids ID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 25
Rings 4
Aromatic Rings 0
Rotatable Bonds 2
Van der Waals Molecular Volume 349.66
Topological Polar Surface Area 74.60
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
logP 3.24
Molar Refractivity 94.68

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Created at
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Updated at
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