Androsterone

C₁₉H₃₀O₂CAS 53-41-8290.45 g/mol

Open in Covalent MOL file

Alcohol Ketone

Properties

Molecular formula: C₁₉H₃₀O₂
Molar mass: 290.45 g/mol
Exact mass: 290.2246 Da
Density: 1.16 g/mL
Melting point: 185 °C
logP: 3.96Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0
Stereocentres: S, R, S, R, S, S, Sin SMILES atom order

Hazards

Danger

H315 Causes skin irritation94.5% of notifiers
H319 Causes serious eye irritation94.5% of notifiers
H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled93.2% of notifiers
H335 May cause respiratory irritation93.2% of notifiers

Aggregated from 73 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P233, P260, P261, P264, P264+P265, P271, P280, P284, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, P501

Identifiers

CAS number

53-41-8

SMILES

C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12

InChIKey

QGXBDMJGAMFCBF-HLUDHZFRSA-N

InChI

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

Weigh it out

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

Names and synonyms

16 names · show all

Androstan-17-one, 3-hydroxy-, (3α,5α)-
(3α,5α)-3-Hydroxyandrostan-17-one
5α-Androsterone
3-Epihydroxyetioallocholan-17-one
3α-Hydroxy-5α-androstan-17-one
3α-Hydroxy-17-androstanone
3α-Hydroxyetioallocholan-17-one
Atromide ICI
3α-Hydroxy-5α-androstane-17-one
5α-Androstane-3α-ol-17-one
5α-Androstan-3α-ol-17-one
Androkinin
Androtin
U 60366
NSC 9898
5α-Androstan-17-one-3α-ol

Work with Androsterone

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Epiandrosterone481-29-8Diastereomer Etiocholanolone53-42-9Diastereomer

Similar compounds

3β-Acetoxy-5α-androstan-17-one1239-31-265 % similar Androstanedione846-46-864 % similar 3α-Hydroxy-5α-pregnan-20-one516-54-160 % similar Isopregnanolone516-55-260 % similar 5α-Androst-2-en-17-one963-75-760 % similar 3α-Androstanediol1852-53-558 % similar 5Alpha-Androstane-3beta,17beta-diol571-20-058 % similar Lithocholic acid434-13-957 % similar

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

Same formula

4-Androstenediol1156-92-9 p-Dodecyloxybenzaldehyde24083-19-0 Androstenediol521-17-5 Dihydrotestosterone521-18-6 5α-Androst-1-ene-3β,17β-diol5323-27-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook