ChemSpider 2D Image | Chaetoglobosin F | C32H38N2O5

Chaetoglobosin F

  • Molecular FormulaC32H38N2O5
  • Average mass530.654 Da
  • Monoisotopic mass530.278076 Da
  • ChemSpider ID10406723
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 9 of 9 defined stereocentres


More details:






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

(1E,4S,5E,8S,11aR,14S,14aR,15S,15aR,16aS,16bR)-8-Hydroxy-14-(1H-indol-3-ylmethyl)-4,6,15,15a-tetramethyl-9,10,14,14a,15,15a,16a,16b-octahydro-3H-cyclotrideca[d]oxireno[f]isoindol-7,11,12(4H,8H,13H)-tr ion [German] [ACD/IUPAC Name]
(1E,4S,5E,8S,11aR,14S,14aR,15S,15aR,16aS,16bR)-8-Hydroxy-14-(1H-indol-3-ylmethyl)-4,6,15,15a-tetramethyl-9,10,14,14a,15,15a,16a,16b-octahydro-3H-cyclotrideca[d]oxireno[f]isoindole-7,11,12(4H,8H,13H)-t rione [ACD/IUPAC Name]
(1E,4S,5E,8S,11aR,14S,14aR,15S,15aR,16aS,16bR)-8-Hydroxy-14-(1H-indol-3-ylméthyl)-4,6,15,15a-tétraméthyl-9,10,14,14a,15,15a,16a,16b-octahydro-3H-cyclotridéca[d]oxiréno[f]isoindole-7,11,12(4H,8H,13H)-t rione [French] [ACD/IUPAC Name]
3H-Cyclotridec[d]oxireno[f]isoindole-7,11,12(4H,8H,13H)-trione, 9,10,14,14a,15,15a,16a,16b-octahydro-8-hydroxy-14-(1H-indol-3-ylmethyl)-4,6,15,15a-tetramethyl-, (1E,4S,5E,8S,11aR,14S,14aR,15S,15aR,16a S,16bR)- [ACD/Index Name]
Chaetoglobosin F
(1E,4S,5E,8S,11aR,14S,14aR,15S,15aR,16aS,16bR)-8-hydroxy-14-(1H-indol-3-ylmethyl)-4,6,15,15a-tetramethyl-9,10,14,14a,15,15a,16a,16b-octahydro-3H-cyclotrideca[d]oxireno[f]isoindole-7,11,12(4H,8H,13H)-t
(1E,4S,5E,8S,11aR,14S,14aR,15S,15aR,16aS,16bR)-8-hydroxy-14-(1H-indol-3-ylmethyl)-4,6,15,15a-tetramethyl-9,10,14,14a,15,15a,16a,16b-octahydro-3H-cyclotrideca[d]oxireno[f]isoindole-7,11,12(4H,8H,13H)-trione
55945-75-0 [RN]
rione
  • Miscellaneous
    • Chemical Class:

      A cytochalasan alkaloid found in <ital>Chaetomium globosum</ital> and <ital>Chaetomium subaffine</ital>. ChEBI CHEBI:68732

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

Density: 1.3±0.1 g/cm3
Boiling Point: 798.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 121.7±3.0 kJ/mol
Flash Point: 436.5±32.9 °C
Index of Refraction: 1.639
Molar Refractivity: 147.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 3.23
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: 112 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 60.0±5.0 dyne/cm
Molar Volume: 411.3±5.0 cm3

Click to predict properties on the Chemicalize site






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