ChemSpider 2D Image | viomellein | C30H24O11

viomellein

  • Molecular FormulaC30H24O11
  • Average mass560.505 Da
  • Monoisotopic mass560.131836 Da
  • ChemSpider ID2297893

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,3'R)-9',10,10'-Trihydroxy-7,7'-dimethoxy-3,3'-dimethyl-3,3',4,4'-tetrahydro-1H,1'H-8,8'-bibenzo[g]isochromen-1,1',6,9-tetron [German] [ACD/IUPAC Name]
(3R,3'R)-9',10,10'-Trihydroxy-7,7'-dimethoxy-3,3'-dimethyl-3,3',4,4'-tetrahydro-1H,1'H-8,8'-bibenzo[g]isochromene-1,1',6,9-tetrone [ACD/IUPAC Name]
(3R,3'R)-9',10,10'-Trihydroxy-7,7'-diméthoxy-3,3'-diméthyl-3,3',4,4'-tétrahydro-1H,1'H-8,8'-bibenzo[g]isochromène-1,1',6,9-tétrone [French] [ACD/IUPAC Name]
[8,8'-Bi-1H-naphtho[2,3-c]pyran]-1,1',6,9-tetrone, 3,3',4,4'-tetrahydro-9',10,10'-trihydroxy-7,7'-dimethoxy-3,3'-dimethyl-, (3R,3'R)- [ACD/Index Name]
55625-78-0 [RN]
viomellein
(3R)-8-[(3R)-9,10-DIHYDROXY-7-METHOXY-3-METHYL-1-OXO-1H,3H,4H-NAPHTHO[2,3-C]PYRAN-8-YL]-10-HYDROXY-7-METHOXY-3-METHYL-1H,3H,4H,6H,9H-NAPHTHO[2,3-C]PYRAN-1,6,9-TRIONE
(3R)-8-[(3R)-9,10-DIHYDROXY-7-METHOXY-3-METHYL-1-OXO-3H,4H-NAPHTHO[2,3-C]PYRAN-8-YL]-10-HYDROXY-7-METHOXY-3-METHYL-3H,4H-NAPHTHO[2,3-C]PYRAN-1,6,9-TRIONE
(8,8'-BI-1H-NAPHTHO(2,3-c)PYRAN)-1,1',6,9-TETRONE, 3,3',4,4'-TETRAHYDRO-7,7'-DIM
(8,8'-Bi-1H-naphtho(2,3-c)pyran)-1,1',6,9-tetrone, 3,3',4,4'-tetrahydro-7,7'-dimethoxy-3,3'-dimethyl-9',10,10'-trihydroxy-, (R-(R*,R*))-
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

9R5RC7QX9B [DBID]
BRN 4630536 [DBID]
UNII:9R5RC7QX9B [DBID]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 915.1±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 137.6±3.0 kJ/mol
    Flash Point: 306.4±27.8 °C
    Index of Refraction: 1.732
    Molar Refractivity: 139.1±0.4 cm3
    #H bond acceptors: 11
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 2
    ACD/LogP: 4.35
    ACD/LogD (pH 5.5): 2.63
    ACD/BCF (pH 5.5): 14.51
    ACD/KOC (pH 5.5): 45.49
    ACD/LogD (pH 7.4): 1.09
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.33
    Polar Surface Area: 166 Å2
    Polarizability: 55.1±0.5 10-24cm3
    Surface Tension: 88.9±5.0 dyne/cm
    Molar Volume: 347.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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