ChemSpider 2D Image | (3beta,5alpha,7alpha,16xi,17S,21alpha)-17,21-Dihydroxy-4-propylajmalan-4-ium | C23H33N2O2

(3β,5α,7α,16ξ,17S,21α)-17,21-Dihydroxy-4-propylajmalan-4-ium

  • Molecular FormulaC23H33N2O2
  • Average mass369.520 Da
  • Monoisotopic mass369.253662 Da
  • ChemSpider ID21106590

  • Charge - Charge

    defined stereocentres - 8 of 10 defined stereocentres

More details:

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

(3β,5α,7α,16ξ,17S,21α)-17,21-Dihydroxy-4-propylajmalan-4-ium [ACD/IUPAC Name]
(3β,5α,7α,16ξ,17S,21α)-17,21-Dihydroxy-4-propylajmalan-4-ium [German] [ACD/IUPAC Name]
(3β,5α,7α,16ξ,17S,21α)-17,21-Dihydroxy-4-propylajmalan-4-ium [French] [ACD/IUPAC Name]
Ajmalan-4-ium, 17,21-dihydroxy-4-propyl-, (3β,5α,7α,16ξ,17S,21α)- [ACD/Index Name]
(3β,5α,7α,16ξ,17S,21α)-4-propylajmalan-4-ium-17,21-diol
prajmalium

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -3.90
ACD/LogD (pH 5.5): -3.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 44 Å2
Polarizability:
Surface Tension:
Molar Volume:

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