ChemSpider 2D Image | 8,15,16-Trihydroxy-11,12-dimethoxy-3a-methyl-1,2,3a,4-tetrahydrochromeno[2',3':6,7]naphtho[2,1-g][1,3]oxazolo[3,2-b]isoquinoline-14,17-dione | C29H23NO9

8,15,16-Trihydroxy-11,12-dimethoxy-3a-methyl-1,2,3a,4-tetrahydrochromeno[2',3':6,7]naphtho[2,1-g][1,3]oxazolo[3,2-b]isoquinoline-14,17-dione

  • Molecular FormulaC29H23NO9
  • Average mass529.494 Da
  • Monoisotopic mass529.137268 Da
  • ChemSpider ID4590413

More details:






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

[1]Benzopyrano[2',3':6,7]naphth[2,1-g]oxazolo[3,2-b]isoquinoline-14,17-dione, 1,2,3a,4-tetrahydro-8,15,16-trihydroxy-11,12-dimethoxy-3a-methyl- [ACD/Index Name]
8,15,16-Trihydroxy-11,12-dimethoxy-3a-methyl-1,2,3a,4-tetrahydrochromeno[2',3':6,7]naphtho[2,1-g][1,3]oxazolo[3,2-b]isochinolin-14,17-dion [German] [ACD/IUPAC Name]
8,15,16-Trihydroxy-11,12-dimethoxy-3a-methyl-1,2,3a,4-tetrahydrochromeno[2',3':6,7]naphtho[2,1-g][1,3]oxazolo[3,2-b]isoquinoline-14,17-dione [ACD/IUPAC Name]
8,15,16-Trihydroxy-11,12-diméthoxy-3a-méthyl-1,2,3a,4-tétrahydrochroméno[2',3':6,7]naphto[2,1-g][1,3]oxazolo[3,2-b]isoquinoléine-14,17-dione [French] [ACD/IUPAC Name]
82658-23-9 [RN]
Cervinomycin A(sub 1)
Cervinomycin A1

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

BRN 4775337 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 894.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 134.4±3.0 kJ/mol
Flash Point: 494.6±34.3 °C
Index of Refraction: 1.811
Molar Refractivity: 137.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 104.87
ACD/KOC (pH 5.5): 971.46
ACD/LogD (pH 7.4): 2.83
ACD/BCF (pH 7.4): 77.15
ACD/KOC (pH 7.4): 714.73
Polar Surface Area: 135 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 100.0±5.0 dyne/cm
Molar Volume: 318.9±5.0 cm3

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