ChemSpider 2D Image | 2-Cyano-N-ethyl-3,12-dioxooleana-1,9(11)-dien-28-amide | C33H46N2O3

2-Cyano-N-ethyl-3,12-dioxooleana-1,9(11)-dien-28-amide

  • Molecular FormulaC33H46N2O3
  • Average mass518.730 Da
  • Monoisotopic mass518.350830 Da
  • ChemSpider ID31127219

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

2-Cyan-N-ethyl-3,12-dioxooleana-1,9(11)-dien-28-amid [German] [ACD/IUPAC Name]
2-Cyano-N-ethyl-3,12-dioxooleana-1,9(11)-dien-28-amide [ACD/IUPAC Name]
2-Cyano-N-éthyl-3,12-dioxooléana-1,9(11)-dién-28-amide [French] [ACD/IUPAC Name]
Oleana-1,9(11)-dien-28-amide, 2-cyano-N-ethyl-3,12-dioxo- [ACD/Index Name]
(4aS,6aR,6bS,8aR,12aS,14aR,14bS)-11-cyano-N-ethyl-2,2,6a,6b,9,9,12a-heptamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxamide
2-(2-Phenylhydrazono)malonic acid
2-?cyano-?N-?ethyl-?3,?12-?dioxo-Oleana-?1,?9(11)?-?dien-?28-?amide
932730-51-3 [RN]
CDDO ethyl amide
CDDO ethyl amide;RTA405;TP319;RTA 405;TP 319;RTA-405;TP-319
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      CDDO-EA(CDDO ethyl amide; RTA 405; TP319) is an activator of Nrf2/ARE; Neuroprotective effect. MedChem Express
      CDDO-EA(CDDO ethyl amide; RTA 405; TP319) is an activator of Nrf2/ARE; Neuroprotective effect.;IC50 value:;Target: Nrf2/ARE activator;The mechanisms of action of CDDO-ME and CDDO-EA that are germane to these in vivo findings are the following results shown here in cell culture: (a) suppression of the ability of IFN-gamma to induce de novo formation of nitric oxide synthase in a macrophage-like cell line RAW264.7, (b) induction of heme oxygenase-1 in these RAW cells, and (c) suppression of phosphorylation of the transcription factor signal transducers and activators of transcription 3 as well as induction of apoptosis in human lung cancer cell lines [1]. the synthetic oleanane triterpenoids, CDDO-Imidazolide (CDDO-Im) and CDDO-Ethyl amide (CDDO-EA), at concentrations as low as 200 nM, induce chondrogenesis in organ cultures of newborn mouse calvaria. The cartilage phenotype was measured histologically with metachromatic toluidine blue staining for proteoglycans and by immunohistoch MedChem Express HY-12213
      Keap1-Nrf2 MedChem Express HY-12213
      NF-KB; MedChem Express HY-12213

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 670.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.5±3.0 kJ/mol
Flash Point: 359.4±31.5 °C
Index of Refraction: 1.563
Molar Refractivity: 147.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 5.52
ACD/LogD (pH 5.5): 5.97
ACD/BCF (pH 5.5): 20204.39
ACD/KOC (pH 5.5): 42016.91
ACD/LogD (pH 7.4): 5.97
ACD/BCF (pH 7.4): 20204.41
ACD/KOC (pH 7.4): 42016.95
Polar Surface Area: 87 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 47.6±5.0 dyne/cm
Molar Volume: 455.7±5.0 cm3

Click to predict properties on the Chemicalize site


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