Found 4 results

Search term: YPZCOEDTKIYBEB (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (1alpha,2beta,4bbeta,10beta)-2,7-Dihydroxy-1-methyl-8-methylenegibbane-1,4a,10-tricarboxylic acid | C20H26O8

(1α,2β,4bβ,10β)-2,7-Dihydroxy-1-methyl-8-methylenegibbane-1,4a,10-tricarboxylic acid

  • Molecular FormulaC20H26O8
  • Average mass394.416 Da
  • Monoisotopic mass394.162781 Da
  • ChemSpider ID58817040

  • defined stereocentres - 7 of 8 defined stereocentres

More details:

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

(1α,2β,4bβ,10β)-2,7-Dihydroxy-1-methyl-8-methylenegibbane-1,4a,10-tricarboxylic acid [ACD/IUPAC Name]
(1α,2β,4bβ,10β)-2,7-Dihydroxy-1-methyl-8-methylengibban-1,4a,10-tricarbonsäure [German] [ACD/IUPAC Name]
Acide (1α,2β,4bβ,10β)-2,7-dihydroxy-1-méthyl-8-méthylènegibbane-1,4a,10-tricarboxylique [French] [ACD/IUPAC Name]
Gibbane-1,4a,10-tricarboxylic acid, 2,7-dihydroxy-1-methyl-8-methylene-, (1α,2β,4bβ,10β)- [ACD/Index Name]
32780-05-5 [RN]
gibberellin 28
gibberellin A28

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

Density: 1.5±0.1 g/cm3
Boiling Point: 585.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 100.3±6.0 kJ/mol
Flash Point: 321.6±26.6 °C
Index of Refraction: 1.646
Molar Refractivity: 94.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 0.27
ACD/LogD (pH 5.5): -3.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 152 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 80.6±5.0 dyne/cm
Molar Volume: 259.1±5.0 cm3

Click to predict properties on the Chemicalize site


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