chempirical

1-Testosterone

C19H28O2CAS 65-06-5288.43 g/mol

Open in Covalent MOL file
OHO
AlcoholAlkeneKetone

Properties

Molecular formula
C19H28O2
Molar mass
288.43 g/mol
Exact mass
288.2089 Da
Melting point
220 °C
logP
3.74Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0
Stereocentres
R, S, R, S, S, S, Sin SMILES atom order

Identifiers

CAS number
65-06-5
SMILES
C[C@]12C=CC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12
InChIKey
OKJCFMUGMSVJBG-ABEVXSGRSA-N
InChI
InChI=1S/C19H28O2/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/h7,9,12,14-17,21H,3-6,8,10-11H2,1-2H3/t12-,14-,15-,16-,17-,18-,19-/m0/s1

Weigh it out

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

Names and synonyms

7 names
  • Androst-1-en-3-one, 17-hydroxy-, (5α,17β)-
  • 5α-Androst-1-en-3-one, 17β-hydroxy-
  • (5α,17β)-17-Hydroxyandrost-1-en-3-one
  • 17β-Hydroxy-5α-androst-1-en-3-one
  • 5α-Androst-1-en-17β-ol-3-one
  • NSC 121140
  • NSC 39366

Work with 1-Testosterone

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

Methenolone153-00-461 % similar 5α-Androst-1-ene-3β,17β-diol5323-27-360 % similar Methyl-1-testosterone65-04-360 % similar Dihydrotestosterone521-18-657 % similar 1α-Methyl-5α-androstan-17β-ol-3-one1424-00-653 % similar 3α-Androstanediol1852-53-550 % similar 3β-Androstanediol571-20-050 % similar Boldenone846-48-048 % similar

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

Same formula

Ment3764-87-2 Epitestosterone481-30-1 Methylnortestosterone514-61-4 Dehydroepiandrosterone53-43-0 4-Dehydroepiandrosterone571-44-8 Testosterone58-22-0 Androstanedione846-46-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook