ChemSpider 2D Image | (3beta,4beta,19E)-9-[(14beta)-14,15-Dihydroeburnamenin-14-yl]-10,17-dihydroxy-4-methylcoryn-19-en-4-ium | C39H49N4O2

(3β,4β,19E)-9-[(14β)-14,15-Dihydroeburnamenin-14-yl]-10,17-dihydroxy-4-methylcoryn-19-en-4-ium

  • Molecular FormulaC39H49N4O2
  • Average mass605.831 Da
  • Monoisotopic mass605.385010 Da
  • ChemSpider ID26339980
  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 6 defined stereocentres


More details:



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(3β,4β,19E)-9-[(14β)-14,15-Dihydroeburnamenin-14-yl]-10,17-dihydroxy-4-methylcoryn-19-en-4-ium [German] [ACD/IUPAC Name]
(3β,4β,19E)-9-[(14β)-14,15-Dihydroeburnamenin-14-yl]-10,17-dihydroxy-4-methylcoryn-19-en-4-ium [ACD/IUPAC Name]
(3β,4β,19E)-9-[(14β)-14,15-Dihydroeburnamenin-14-yl]-10,17-dihydroxy-4-méthylcoryn-19-én-4-ium [French] [ACD/IUPAC Name]
Eburnamenine, 14-[(2R,3E,5R,12bR)-3-ethylidene-1,2,3,4,6,7,12,12b-octahydro-9-hydroxy-2-(2-hydroxyethyl)-5-methylindolo[2,3-a]quinolizinium-8-yl]-14,15-dihydro-, (14β)- [ACD/Index Name]
bisnicalaterine B

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 0.69
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.81
ACD/LogD (pH 7.4): 0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.05
Polar Surface Area: 64 Å2
Polarizability:
Surface Tension:
Molar Volume:

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