ChemSpider 2D Image | strynuxline B | C23H24N2O5

strynuxline B

  • Molecular FormulaC23H24N2O5
  • Average mass408.447 Da
  • Monoisotopic mass408.168518 Da
  • ChemSpider ID28643870

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(11S,20R,21R)-4,5-Dimethoxy-12-oxa-8,17-diazahexacyclo[15.5.2.02,7.08,22.011,21.015,20]tetracosa-1(22),2,4,6,14-pentaen-9,18-dion [German] [ACD/IUPAC Name]
(11S,20R,21R)-4,5-Dimethoxy-12-oxa-8,17-diazahexacyclo[15.5.2.02,7.08,22.011,21.015,20]tetracosa-1(22),2,4,6,14-pentaene-9,18-dione [ACD/IUPAC Name]
(11S,20R,21R)-4,5-Diméthoxy-12-oxa-8,17-diazahexacyclo[15.5.2.02,7.08,22.011,21.015,20]tétracosa-1(22),2,4,6,14-pentaène-9,18-dione [French] [ACD/IUPAC Name]
2H-3,15-Ethanopyrido[4'',3'':4',5']oxepino[3',2':3,4]pyrido[1,2-a]indole-2,9(1H)-dione, 4,6,7a,8,15b,15c-hexahydro-12,13-dimethoxy-, (7aS,15bR,15cR)- [ACD/Index Name]
strynuxline B

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

Density: 1.5±0.1 g/cm3
Boiling Point: 632.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 336.3±31.5 °C
Index of Refraction: 1.737
Molar Refractivity: 106.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.20
ACD/LogD (pH 5.5): 1.70
ACD/BCF (pH 5.5): 11.56
ACD/KOC (pH 5.5): 200.71
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 11.56
ACD/KOC (pH 7.4): 200.71
Polar Surface Area: 70 Å2
Polarizability: 42.3±0.5 10-24cm3
Surface Tension: 59.0±7.0 dyne/cm
Molar Volume: 265.4±7.0 cm3

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