ChemSpider 2D Image | Mometasone furoate | C27H30Cl2O6

Mometasone furoate

  • Molecular FormulaC27H30Cl2O6
  • Average mass521.430 Da
  • Monoisotopic mass520.141968 Da
  • ChemSpider ID390091
  • defined stereocentres - 8 of 8 defined stereocentres


More details:



Featured data source



Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(11b,16a)-9,21-dichloro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl furan-2-carboxylate
(11b,16a)-9,21-Dichloro-17-[(2-furanylcarbonyl)oxy]-11-hydroxy-16-methylpregna-1,4-diene-3,20-dione
(11β,16α)-9,21-Dichlor-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl-2-furoat [German] [ACD/IUPAC Name]
(11β,16α)-9,21-Dichlor-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-ylfuran-2-carboxylat
(11β,16α)-9,21-Dichloro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl 2-furoate [ACD/IUPAC Name]
(11β,16α)-9,21-dichloro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl furan-2-carboxylate
(8S,9R,10S,11S,13S,14S,16R,17R)-9-Chlor-17-(chloracetyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-ylfuran-2-carboxylat
(8S,9R,10S,11S,13S,14S,16R,17R)-9-Chloro-17-(chloroacetyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl 2-furoate
(8S,9R,10S,11S,13S,14S,16R,17R)-9-chloro-17-(chloroacetyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl furan-2-carboxylate
2-furancarboxylic acid, (11b,16a)-9,21-dichloro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl ester
More...

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

04201GDN4R [DBID]
Sch 32088 [DBID]
BRN 4340538 [DBID]
C07817 [DBID]
D00690 [DBID]
Prestwick_924 [DBID]
Prestwick0_000572 [DBID]
Prestwick1_000572 [DBID]
SPBio_002603 [DBID]
UNII:04201GDN4R [DBID]
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Target Organs:

      Glucocorticoid Receptor inhibitor TargetMol T1531
    • Therapeutical Effect:

      Anti-Inflammatory Agents Sean Ekins
    • Drug Status:

      approved BIONET-Key Organics KS-1275
    • Bio Activity:

      Endocrinology/ Hormones TargetMol T1531
      Glucocorticoid Receptor Tocris Bioscience 4115
      Glucocorticoid Receptor MedChem Express HY-13693
      Glucocorticoid Receptor TargetMol T1531
      GPCR/G protein MedChem Express HY-13693
      GPCR/G protein; MedChem Express HY-13693
      Mometasone furoate, prodrug of the free form mometasone, is a agent with high affinity for the glucocorticoid receptor. MedChem Express
      Mometasone furoate, prodrug of the free form mometasone, is a agent with high affinity for the glucocorticoid receptor.; IC50 value: ; Target: glucocorticosteroid receptor; Mometasone furoate is used in the treatment of inflammatory skin disorders (such as eczema and psoriasis), allergic rhinitis (such as hay fever), asthma [1]. MedChem Express HY-13693
      Mometasone furoate, prodrug of the free form mometasone, is a agent with high affinity for the glucocorticoid receptor.;IC50 value: ;Target: glucocorticosteroid receptorMometasone furoate is used in the treatment of inflammatory skin disorders (such as eczema and psoriasis), allergic rhinitis (such as hay fever), asthma [1]. MF is approved for once or bid maintenance treatment of asthma (in patients previously receiving ICS or bronchodilators). Low systemic bioavailability and high relative binding affinity for the glucocorticoid receptor are properties of MF that allow for a favourable efficacy and tolerability profile. Inhaled MF has been shown to be an effective and well-tolerated controller medication for those patients with mild, moderate or severe persistent asthma [2]. MedChem Express HY-13693
      Nuclear Receptors Tocris Bioscience 4115
      Potent synthetic corticosteroid; displays agonist activity at glucocorticoid and progesterone receptors. Exhibits anti-inflammatory effects. Tocris Bioscience 4115
      Synthetic corticosteroid; anti-inflammatory agent Tocris Bioscience 4115

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 655.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.4±3.0 kJ/mol
Flash Point: 350.2±31.5 °C
Index of Refraction: 1.604
Molar Refractivity: 130.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.27
ACD/LogD (pH 5.5): 3.96
ACD/BCF (pH 5.5): 603.61
ACD/KOC (pH 5.5): 3404.61
ACD/LogD (pH 7.4): 3.96
ACD/BCF (pH 7.4): 603.61
ACD/KOC (pH 7.4): 3404.60
Polar Surface Area: 94 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 56.9±5.0 dyne/cm
Molar Volume: 379.2±5.0 cm3

Click to predict properties on the Chemicalize site





Feedback Form