ChemSpider 2D Image | (2E)-2-Methyl-4-[5,8,9-trihydroxy-2,2-dimethyl-12-(3-methyl-2-buten-1-yl)-6-oxo-2H,6H-pyrano[3,2-b]xanthen-7-yl]-2-buten-1-yl acetate | C30H32O8

(2E)-2-Methyl-4-[5,8,9-trihydroxy-2,2-dimethyl-12-(3-methyl-2-buten-1-yl)-6-oxo-2H,6H-pyrano[3,2-b]xanthen-7-yl]-2-buten-1-yl acetate

  • Molecular FormulaC30H32O8
  • Average mass520.570 Da
  • Monoisotopic mass520.209717 Da
  • ChemSpider ID28288174

  • Double-bond stereo - Double-bond stereo

More details:

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(2E)-2-Methyl-4-[5,8,9-trihydroxy-2,2-dimethyl-12-(3-methyl-2-buten-1-yl)-6-oxo-2H,6H-pyrano[3,2-b]xanthen-7-yl]-2-buten-1-yl acetate [ACD/IUPAC Name]
(2E)-2-Methyl-4-[5,8,9-trihydroxy-2,2-dimethyl-12-(3-methyl-2-buten-1-yl)-6-oxo-2H,6H-pyrano[3,2-b]xanthen-7-yl]-2-buten-1-yl-acetat [German] [ACD/IUPAC Name]
2H,6H-Pyrano[3,2-b]xanthen-6-one, 7-[(2E)-4-(acetyloxy)-3-methyl-2-buten-1-yl]-5,8,9-trihydroxy-2,2-dimethyl-12-(3-methyl-2-buten-1-yl)- [ACD/Index Name]
Acétate de (2E)-2-méthyl-4-[5,8,9-trihydroxy-2,2-diméthyl-12-(3-méthyl-2-butén-1-yl)-6-oxo-2H,6H-pyrano[3,2-b]xanthén-7-yl]-2-butén-1-yle [French] [ACD/IUPAC Name]
bannaxanthone I

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

Density: 1.3±0.1 g/cm3
Boiling Point: 720.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.0±3.0 kJ/mol
Flash Point: 235.4±26.4 °C
Index of Refraction: 1.614
Molar Refractivity: 141.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.21
ACD/LogD (pH 5.5): 6.55
ACD/BCF (pH 5.5): 53934.40
ACD/KOC (pH 5.5): 81567.59
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 7.4): 2117.88
ACD/KOC (pH 7.4): 3202.98
Polar Surface Area: 123 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 53.2±3.0 dyne/cm
Molar Volume: 406.5±3.0 cm3

Click to predict properties on the Chemicalize site


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