chempirical

Estradiol cypionate

C26H36O3CAS 313-06-4396.57 g/mol

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EsterPhenol

Properties

Molecular formula
C26H36O3
Molar mass
396.57 g/mol
Exact mass
396.2664 Da
Melting point
151–152 °C
logP
6.13Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4
Stereocentres
S, S, R, S, Sin SMILES atom order

Identifiers

CAS number
313-06-4
SMILES
C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
InChIKey
UOACKFBJUYNSLK-XRKIENNPSA-N
InChI
InChI=1S/C26H36O3/c1-26-15-14-21-20-10-8-19(27)16-18(20)7-9-22(21)23(26)11-12-24(26)29-25(28)13-6-17-4-2-3-5-17/h8,10,16-17,21-24,27H,2-7,9,11-15H2,1H3/t21-,22-,23+,24+,26+/m1/s1

Weigh it out

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

Names and synonyms

21 names · show all
  • Estra-1,3,5(10)-triene-3,17-diol (17β)-, 17-cyclopentanepropanoate
  • Estradiol, 17-cyclopentanepropionate
  • Cyclopentanepropionic acid, 3-hydroxyestra-1,3,5(10)-trien-17β-yl ester
  • Cyclopentanepropionic acid, 17-ester with estradiol
  • Depoestradiol
  • Depo-estradiol cyclopentylpropionate
  • Depofemin
  • Estradiol 17β-cyclopentanepropionate
  • Estradiol 17β-cyclopentylpropionate
  • Estradiol cyclopentylpropionate
  • 17β-Estradiol 17-cyclopentylpropionate
  • Estradiol 17β-cypionate
  • Depoestradiol cypionate
  • Estradiol 17-cypionate
  • ECP
  • Estradep
  • Depo-estradiol
  • Estradiol 17-cyclopentylpropionate
  • Depgynogen
  • NSC 3354
  • Estradiolum valerianicum

Work with Estradiol cypionate

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

Estradiol valerate979-32-881 % similar Estradiol enanthate4956-37-079 % similar Estra-1,3,5(10)-triene-3,17β-diol 17-acetate1743-60-872 % similar Estradiol50-28-260 % similar 17α-Estradiol57-91-060 % similar Dimenformon dipropionate113-38-260 % similar Estradiol hemihydrate35380-71-358 % similar Estrone53-16-754 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook