Cortisol 21-Cyclopentanepropionate

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Properties Simple | Detailed

Formula C29H42O6
IUPAC Name [2-[(8s,9s,10r,11s,13s,14s,17r)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] 3-cyclopentylpropanoate
Molecular Mass 486.640 g·mol−1
Heat of Formation -1259.6 ± 16.7 kJ·mol−1
Dipole Moment 4.86 ± 1.08 D
Volume 599.96 Å 3
Surface Area 471.96 Å 2
HOMO Energy -9.74 ± 0.55 eV
LUMO Energy 3.03 ± eV
Point Group Symmetry C1
Synonyms
  • 17-(3-cyclopentyl-1-propionyl)-11beta,17alpha,21-trihydroxypregn-4-ene-3,20-dione
  • 17-hydroxycorticosterone 21.beta.-cyclopentylpropionate
  • 3-cyclopentylpropanoic acid [2-[(8s,9s,10r,11s,13s,14s,17r)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] ester
  • 3-cyclopentylpropionic acid [2-[(8s,9s,10r,11s,13s,14s,17r)-11,17-dihydroxy-3-keto-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-keto-ethyl] ester
  • [2-[(8s,9s,10r,11s,13s,14s,17r)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] 3-cyclopentylpropanoate
  • cortef fluid
  • cortisol, 21-cyclopentanepropionate
  • d00976
  • hydrocortisone 21.beta.-cyclopentanepropionate
  • hydrocortisone cyclopentyl propionate
  • hydrocortisone cypionate
  • lmst02030121
  • pregn-4-ene-3,20-dione, 21-(3-cyclopentyl-1-oxopropoxy)-11,17-dihydroxy-, (11.beta.)-
CAS Number(s)
  • 508-99-6
InChIKey DLVOSEUFIRPIRM-KAQKJVHQSA-N
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