ChemSpider 2D Image | cytoglobosin F | C32H38N2O5

cytoglobosin F

  • Molecular FormulaC32H38N2O5
  • Average mass530.654 Da
  • Monoisotopic mass530.278076 Da
  • ChemSpider ID27025349

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3S,3aR,4S,6S,6aR,7E,10S,11E,13R,17aR)-6,13-Dihydroxy-3-(1H-indol-3-ylmethyl)-4,10,12-trimethyl-5-methylen-2,3,3a,4,5,6,6a,9,10,13,15,16-dodecahydro-1H-cyclotrideca[d]isoindol-1,14,17-trion [German] [ACD/IUPAC Name]
(3S,3aR,4S,6S,6aR,7E,10S,11E,13R,17aR)-6,13-Dihydroxy-3-(1H-indol-3-ylmethyl)-4,10,12-trimethyl-5-methylene-2,3,3a,4,5,6,6a,9,10,13,15,16-dodecahydro-1H-cyclotrideca[d]isoindole-1,14,17-trione [ACD/IUPAC Name]
(3S,3aR,4S,6S,6aR,7E,10S,11E,13R,17aR)-6,13-Dihydroxy-3-(1H-indol-3-ylméthyl)-4,10,12-triméthyl-5-méthylène-2,3,3a,4,5,6,6a,9,10,13,15,16-dodécahydro-1H-cyclotridéca[d]isoindole-1,14,17-trione [French] [ACD/IUPAC Name]
1H-Cyclotridec[d]isoindole-1,14,17-trione, 2,3,3a,4,5,6,6a,9,10,13,15,16-dodecahydro-6,13-dihydroxy-3-(1H-indol-3-ylmethyl)-4,10,12-trimethyl-5-methylene-, (3S,3aR,4S,6S,6aR,7E,10S,11E,13R,17aR)- [ACD/Index Name]
cytoglobosin F
  • Miscellaneous

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

Density: 1.3±0.1 g/cm3
Boiling Point: 822.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.4±3.0 kJ/mol
Flash Point: 451.4±34.3 °C
Index of Refraction: 1.637
Molar Refractivity: 149.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 3.41
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 119 Å2
Polarizability: 59.2±0.5 10-24cm3
Surface Tension: 60.4±5.0 dyne/cm
Molar Volume: 416.1±5.0 cm3

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