chempirical

Penmesterol

C25H38O2CAS 67-81-2370.58 g/mol

Open in Covalent MOL file
OHO
AlcoholAlkeneEther

Properties

Molecular formula
C25H38O2
Molar mass
370.58 g/mol
Exact mass
370.2872 Da
Melting point
150 °C
logP
6.15Crippen estimate
Polar surface area
29.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2
Stereocentres
R, R, S, S, S, Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
67-81-2
SMILES
C[C@]12CCC(OC3CCCC3)=CC1=CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O
InChIKey
ZUBDXGHKAAMAAA-RFXJPFPRSA-N
InChI
InChI=1S/C25H38O2/c1-23-13-10-19(27-18-6-4-5-7-18)16-17(23)8-9-20-21(23)11-14-24(2)22(20)12-15-25(24,3)26/h8,16,18,20-22,26H,4-7,9-15H2,1-3H3/t20-,21+,22+,23+,24+,25+/m1/s1

Weigh it out

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

Names and synonyms

8 names
  • (17β)-3-(Cyclopentyloxy)-17-methylandrosta-3,5-dien-17-ol
  • Androsta-3,5-dien-17-ol, 3-(cyclopentyloxy)-17-methyl-, (17β)-
  • Androsta-3,5-dien-17β-ol, 3-(cyclopentyloxy)-17-methyl-
  • 3-(Cyclopentyloxy)-17-methyl-androsta-3,5-dien-17β-ol
  • 17α-Methyltestosterone 3-cyclopentyl enol ether
  • Penmestrol
  • Pandrocine
  • RP 12222

Work with Penmesterol

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

Methandriol521-10-856 % similar Methyltestosterone58-18-448 % similar Oxymesterone145-12-046 % similar Methylnortestosterone514-61-440 % similar Methandrostenolone72-63-938 % similar 17-Hydroxypregnenolone387-79-138 % similar 17β-Hydroxy-2-(hydroxymethylene)-17-methyl-5α-androstan-3-one434-07-137 % similar Methandriol dipropionate3593-85-936 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook