ChemSpider 2D Image | Kuwanon G | C40H36O11

Kuwanon G

  • Molecular FormulaC40H36O11
  • Average mass692.707 Da
  • Monoisotopic mass692.225769 Da
  • ChemSpider ID4444986

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

4H-1-Benzopyran-4-one, 8-[(1S,5R,6S)-6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methyl-2-buten-1-yl)- [ACD/Index Name]
4H-1-Benzopyran-4-one, 8-[(1S,5R,6S)-6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methyl-2-butenyl)-
75629-19-5 [RN]
8-[(1S,5R,6S)-6-(2,4-Dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methyl-2-buten-1-yl)-4H-chromen-4-on [German] [ACD/IUPAC Name]
8-[(1S,5R,6S)-6-(2,4-Dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methyl-2-buten-1-yl)-4H-chromen-4-one [ACD/IUPAC Name]
8-[(1S,5R,6S)-6-(2,4-Dihydroxybenzoyl)-5-(2,4-dihydroxyphényl)-3-méthyl-2-cyclohexén-1-yl]-2-(2,4-dihydroxyphényl)-5,7-dihydroxy-3-(3-méthyl-2-butén-1-yl)-4H-chromén-4-one [French] [ACD/IUPAC Name]
8-[(1S,5R,6S)-6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methylbut-2-en-1-yl)-4H-chromen-4-one
kumanon G
Kuwanon G [Wiki]
Kuwanone G
More...

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

AIDS071507 [DBID]
AIDS-071507 [DBID]
C10099 [DBID]
  • Miscellaneous

    • Chemical Class:

      A tetrahydroxyflavone isolated from the root barks of <ital>Morus alba </ital> and has been shown to exhibit anti-inflammatory activity. ChEBI CHEBI:6146
      A tetrahydroxyflavone isolated from the root barks of Morus alba and has been shown to exhibit anti-inflammatory activity. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:6146
      A tetrahydroxyflavone isolated from the root barks of Morus alba and has been shown to exhibit anti-inflammatory activity. ChEBI CHEBI:6146

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

Density: 1.4±0.1 g/cm3
Boiling Point: 942.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 141.8±3.0 kJ/mol
Flash Point: 293.9±27.8 °C
Index of Refraction: 1.708
Molar Refractivity: 186.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 8
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 4
ACD/LogP: 7.06
ACD/LogD (pH 5.5): 6.58
ACD/BCF (pH 5.5): 57199.71
ACD/KOC (pH 5.5): 84738.18
ACD/LogD (pH 7.4): 5.13
ACD/BCF (pH 7.4): 2028.23
ACD/KOC (pH 7.4): 3004.71
Polar Surface Area: 205 Å2
Polarizability: 74.0±0.5 10-24cm3
Surface Tension: 72.6±3.0 dyne/cm
Molar Volume: 478.9±3.0 cm3

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