chempirical

Testosterone 17-acetate

C21H30O3CAS 1045-69-8330.47 g/mol

Open in Covalent MOL file
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AlkeneEsterKetone

Properties

Molecular formula
C21H30O3
Molar mass
330.47 g/mol
Exact mass
330.2195 Da
Melting point
140–141 °C
logP
4.45Crippen estimate
Polar surface area
43.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1
Stereocentres
S, S, R, R, S, Sin SMILES atom order

Identifiers

CAS number
1045-69-8
SMILES
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
InChIKey
DJPZSBANTAQNFN-PXQJOHHUSA-N
InChI
InChI=1S/C21H30O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h12,16-19H,4-11H2,1-3H3/t16-,17-,18-,19-,20-,21-/m0/s1

Weigh it out

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

Names and synonyms

23 names · show all
  • Testosterone, acetate
  • Androst-4-en-3-one, 17-(acetyloxy)-, (17β)-
  • (17β)-17-(Acetyloxy)androst-4-en-3-one
  • Aceto-sterandryl
  • Aceto-testoviron
  • 17β-Acetoxy-δ4-androsten-3-one
  • 17β-Acetoxy-4-androsten-3-one
  • Perandrone A
  • SKF 5647
  • 17β-Hydroxyandrost-4-en-3-one-17β-acetate
  • Androst-4-en-17β-ol-3-one acetate
  • 17β-Hydroxyandrost-4-en-3-one acetate
  • Amolisin
  • Androtest A
  • Deposteron
  • Farmatest
  • 3-Oxoandrost-4-en-17β-yl acetate
  • 4-Androsten-17β-ol-3-one 17-acetate
  • 17β-Acetoxyandrost-4-ene-3-one
  • 17β-Acetoxytestosterone
  • 17-O-Acetyltestosterone
  • NSC 523836
  • 4-Androstene-17β-ol-3-one acetate

Work with Testosterone 17-acetate

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

17β-Hydroxyandrost-4-en-3-one propionate57-85-275 % similar Testosterone isocaproate15262-86-974 % similar Testosterone cypionate58-20-871 % similar Androst-4-en-17β-ol-3-one benzoate2088-71-369 % similar Testosterone enanthate315-37-769 % similar Testosterone caprinate5721-91-569 % similar Testosterone undecylate5949-44-069 % similar Deoxycorticosterone acetate56-47-368 % similar

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

Same formula

Methyl (17β)-3-oxoandrost-4-ene-17-carboxylate2681-55-2 17β-Hydroxyprogesterone604-09-1 Trestolone acetate6157-87-5 11-Deoxycorticosterone64-85-7 17α-Hydroxyprogesterone68-96-2 Nandrolone propionate7207-92-3 11α-Hydroxyprogesterone80-75-1 (3S,5R,6R,7R,8R,9S,10R,13S,14S,15S,16S)-Octadecahydro-3,5-dihydroxy-10,13-dimethyl-17H-dicyclopropa[6,7:15,16]cyclopenta[A]phenanthren-17-one82543-16-6

Elsewhere

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