ChemSpider 2D Image | Cefalochromin | C28H22O10

Cefalochromin

  • Molecular FormulaC28H22O10
  • Average mass518.468 Da
  • Monoisotopic mass518.121277 Da
  • ChemSpider ID140746

More details:

Featured data source
Natural Product Updates

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

[9,9'-Bi-2H-naphtho[2,3-b]pyran]-4,4'(3H,3'H)-dione, 5,5',6,6',8,8'-hexahydroxy-2,2'-dimethyl- [ACD/Index Name]
2,2',3,3'-Tetrahydro-5,5',6,6',8,8'-hexahydroxy-2,2'-dimethyl-9,9'-bi-4H-naphtho(2,3-b)pyran-4,4'-dione
5,5',6,6',8,8'-Hexahydroxy-2,2'-dimethyl-2,2',3,3'-tetrahydro-4H,4'H-9,9'-bibenzo[g]chromen-4,4'-dion [German] [ACD/IUPAC Name]
5,5',6,6',8,8'-Hexahydroxy-2,2'-dimethyl-2,2',3,3'-tetrahydro-4H,4'H-9,9'-bibenzo[g]chromene-4,4'-dione [ACD/IUPAC Name]
5,5',6,6',8,8'-Hexahydroxy-2,2'-diméthyl-2,2',3,3'-tétrahydro-4H,4'H-9,9'-bibenzo[g]chromène-4,4'-dione [French] [ACD/IUPAC Name]
Cefalochromin
Ustilaginoidin F
2,2',3,3'-Tetrahydro-5,5',6,6',8,8'-hexahydroxy-2,2'-dimethyl-9,9'-bi[4H-naphtho[2,3-b]pyran]-4,4'-dione
25908-26-3 [RN]
5,6,8-trihydroxy-2-methyl-9-(5,6,8-trihydroxy-2-methyl-4-oxo-2,3-dihydrobenzo[g]chromen-9-yl)-2,3-dihydrobenzo[g]chromen-4-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AIDS014304 [DBID]
AIDS-014304 [DBID]
NSC201419 [DBID]
NSC627953 [DBID]
Sch 45752 [DBID]
  • Miscellaneous

    • Bio Activity:

      Biochemicals & small molecules Hello Bio HB3825
      Cell process/Apoptosis & cell cycle Hello Bio HB3825
      Mycotoxin. Bis(naphtha-gamma-pyrone) derivative similar to chaetochromin and ustilaginoidin. Antibiotic. Antibacterial, antifungal and anti-algal compound. Antitumor and cytotoxic compound. Calmodulin-sensitive PDE activity inhibitor. Inhibits NO production by activated macrophages. Selective Fabl (bacterial enoyl-acyl carrier protein (ACP) reductase) inhibitor. Inducer of G0/G1 cell cycle arrest and apoptosis in human A549 cells. Hello Bio HB3825
      Selective Fabl inhibitor. Apoptosis inducer. Hello Bio HB3825

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

Density: 1.6±0.1 g/cm3
Boiling Point: 720.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.9±3.0 kJ/mol
Flash Point: 243.5±26.4 °C
Index of Refraction: 1.779
Molar Refractivity: 135.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 3
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.81
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 174 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 85.5±3.0 dyne/cm
Molar Volume: 322.3±3.0 cm3

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