Found 1 result

Search term: 78442600 (Found by CSID)
ChemSpider 2D Image | (1S,3E,13S,15S,18S)-9,18-Dihydroxy-6,7-dimethoxy-13-methyl-12,19-dioxatricyclo[13.3.1.0~5,10~]nonadeca-3,5,7,9-tetraene-11,17-dione | C20H24O8

(1S,3E,13S,15S,18S)-9,18-Dihydroxy-6,7-dimethoxy-13-methyl-12,19-dioxatricyclo[13.3.1.05,10]nonadeca-3,5,7,9-tetraene-11,17-dione

  • Molecular FormulaC20H24O8
  • Average mass392.400 Da
  • Monoisotopic mass392.147125 Da
  • ChemSpider ID78442600

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1S,3E,13S,15S,18S)-9,18-Dihydroxy-6,7-dimethoxy-13-methyl-12,19-dioxatricyclo[13.3.1.05,10]nonadeca-3,5,7,9-tetraen-11,17-dion [German] [ACD/IUPAC Name]
(1S,3E,13S,15S,18S)-9,18-Dihydroxy-6,7-dimethoxy-13-methyl-12,19-dioxatricyclo[13.3.1.05,10]nonadeca-3,5,7,9-tetraene-11,17-dione [ACD/IUPAC Name]
(1S,3E,13S,15S,18S)-9,18-Dihydroxy-6,7-diméthoxy-13-méthyl-12,19-dioxatricyclo[13.3.1.05,10]nonadéca-3,5,7,9-tétraène-11,17-dione [French] [ACD/IUPAC Name]
5,9-Epoxy-1H-2-benzoxacyclotetradecin-1,7(8H)-dione, 3,4,5,6,9,10-hexahydro-8,16-dihydroxy-13,14-dimethoxy-3-methyl-, (3S,5S,8S,9S,11E)- [ACD/Index Name]
Hamigeromycin B

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

Density: 1.3±0.1 g/cm3
Boiling Point: 675.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.1±3.0 kJ/mol
Flash Point: 240.3±25.0 °C
Index of Refraction: 1.548
Molar Refractivity: 98.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.94
ACD/LogD (pH 5.5): 2.08
ACD/BCF (pH 5.5): 22.51
ACD/KOC (pH 5.5): 322.86
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 16.39
ACD/KOC (pH 7.4): 235.10
Polar Surface Area: 112 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 308.7±3.0 cm3

Click to predict properties on the Chemicalize site


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