Structure Database (LMSD)

O H H H H HO
Common Name
Androsterone
Systematic Name
3α-hydroxy-5α-androstan-17-one
Synonyms
  • Androsterone
LM ID
LMST02020001
Formula
C19H30O2
Exact Mass
Calculate m/z
290.22458
Sum Composition
ST 19:1;O2
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Sterol Lipids [ST]
Steroids [ST02]
C19 steroids (androgens) and derivatives [ST0202]

String Representations

InChiKey (Click to copy)
QGXBDMJGAMFCBF-HLUDHZFRSA-N
InChi (Click to copy)
InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18-,19-/m0/s1
SMILES (Click to copy)
C1[C@@H](O)C[C@]2([H])CC[C@@]3([H])[C@]4([H])CCC(=O)[C@@]4(C)CC[C@]3([H])[C@@]2(C)C1

References

Other Databases

Wikipedia
Androsterone
KEGG ID
C00523
HMDB ID
HMDB0000031
CHEBI ID
16032
LIPIDBANK ID
SST0002
PubChem CID
5879
SwissLipids ID
SLM:000001055
Cayman ID
15872
PDB ID
AOI

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 4
Aromatic Rings 0
Rotatable Bonds 0
Van der Waals Molecular Volume 302.76
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 4.25
Molar Refractivity 83.25

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Created at
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Updated at
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