ChemSpider 2D Image | GinkgolideM | C20H24O10

GinkgolideM

  • Molecular FormulaC20H24O10
  • Average mass424.399 Da
  • Monoisotopic mass424.136932 Da
  • ChemSpider ID23498736

  • defined stereocentres - 10 of 12 defined stereocentres

More details:

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

(1S,3R,6R,8S,9S,10S,11S,12S,13R,16S,17S)-6,9,12,16-Tetrahydroxy-8-(2-methyl-2-propanyl)-2,4,14-trioxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadecan-5,15,18-trion [German] [ACD/IUPAC Name]
(1S,3R,6R,8S,9S,10S,11S,12S,13R,16S,17S)-6,9,12,16-Tetrahydroxy-8-(2-methyl-2-propanyl)-2,4,14-trioxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadecane-5,15,18-trione [ACD/IUPAC Name]
(1S,3R,6R,8S,9S,10S,11S,12S,13R,16S,17S)-6,9,12,16-Tétrahydroxy-8-(2-méthyl-2-propanyl)-2,4,14-trioxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadécane-5,15,18-trione [French] [ACD/IUPAC Name]
6H-4a,9-Ethano-3aH,9H-cyclopenta[c]furo[2,3-b]furo[3',2':3,4]cyclopenta[1,2-d]furan-2,6,13(1H)-trione, 11-(1,1-dimethylethyl)hexahydro-1,5,8,10-tetrahydroxy-, (1R,3aR,4aS,4bS,5S,7aR,8S,8aS,9S,10S,11S) - [ACD/Index Name]
GinkgolideM
15291-78-8 [RN]
MFCD09038732 [MDL number]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 783.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.2 mmHg at 25°C
Enthalpy of Vaporization: 130.0±6.0 kJ/mol
Flash Point: 282.0±26.4 °C
Index of Refraction: 1.675
Molar Refractivity: 93.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: -1.25
ACD/LogD (pH 5.5): -1.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.09
ACD/LogD (pH 7.4): -1.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.09
Polar Surface Area: 160 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 87.8±5.0 dyne/cm
Molar Volume: 250.1±5.0 cm3

Click to predict properties on the Chemicalize site


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