chempirical

Adrenosterone

C19H24O3CAS 382-45-6300.40 g/mol

Open in Covalent MOL file
OOO
AlkeneKetone

Properties

Molecular formula
C19H24O3
Molar mass
300.40 g/mol
Exact mass
300.1725 Da
Melting point
222 °C
logP
3.27Crippen estimate
Polar surface area
51.2 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0
Stereocentres
R, S, S, S, Sin SMILES atom order

Identifiers

CAS number
382-45-6
SMILES
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@]2(C)C(=O)CC[C@@H]12
InChIKey
RZRPTBIGEANTGU-IRIMSJTPSA-N
InChI
InChI=1S/C19H24O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h9,13-14,17H,3-8,10H2,1-2H3/t13-,14-,17+,18-,19-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • Androst-4-ene-3,11,17-trione
  • δ4-Androstene-3,11,17-trione
  • 11-Keto-4-androstene-3,17-dione
  • Reichstein's substance G
  • 11-Oxo-4-androstene-3,17-dione
  • Andrenosterone
  • (+)-Adrenosterone
  • NSC 12166
  • Androst-4-en-3,11,17-trione

Work with Adrenosterone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Androstenedione63-05-870 % similar Cortisone53-06-561 % similar Pregn-4-ene-3,11,20-trione516-15-461 % similar Biocort acetate50-04-458 % similar 21-Deoxycortisone1882-82-258 % similar 19-Hydroxyandrostenedione510-64-555 % similar 11-Deoxycorticosterone64-85-750 % similar (+)-Estr-4-ene-3,17-dione734-32-750 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Androst-4-ene-3,6,17-trione2243-06-3 Prallethrin23031-36-9 Testolactone968-93-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia