ChemSpider 2D Image | Cepharanthine: Oxyacanthan,6',12'-dimethoxy-2,2'-dimethy1-6,7-(methyllenebis (oxy))-, | C37H38N2O6

Cepharanthine: Oxyacanthan,6',12'-dimethoxy-2,2'-dimethy1-6,7-(methyllenebis (oxy))-,

  • Molecular FormulaC37H38N2O6
  • Average mass606.707 Da
  • Monoisotopic mass606.273010 Da
  • ChemSpider ID23089059

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(14S,27R)-22,33-Dimethoxy-13,14-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.216,19.13,10.121,25.04,8.014,39.031,35]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dod ecaen [German] [ACD/IUPAC Name]
(14S,27R)-22,33-Dimethoxy-13,14-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.216,19.13,10.121,25.04,8.014,39.031,35]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dod ecaene [ACD/IUPAC Name]
(14S,27R)-22,33-Diméthoxy-13,14-diméthyl-2,5,7,20-tétraoxa-13,28-diazaoctacyclo[25.6.2.216,19.13,10.121,25.04,8.014,39.031,35]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dod écaène [French] [ACD/IUPAC Name]
(14S,27R)-22,33-Dimethoxy-13,14-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.216,19.13,10.121,25.04,8.014,39.031,35]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dodecaene
(14S,27R)-22,33-dimethoxy-13,14-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.216,19.13,10.121,25.04,8.014,39.031,35]nonatriaconta-1(33),3,8,10(39),16,18,21(36),22,24,31,34,37-dodecaene (non-preferred name)
Cepharanthine: Oxyacanthan,6',12'-dimethoxy-2,2'-dimethy1-6,7-(methyllenebis (oxy))-,
MFCD00210482 [MDL number]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.607
Molar Refractivity: 170.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 4.81
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.63
ACD/LogD (pH 7.4): 3.85
ACD/BCF (pH 7.4): 247.48
ACD/KOC (pH 7.4): 784.72
Polar Surface Area: 71 Å2
Polarizability: 67.6±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 494.0±3.0 cm3

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