ChemSpider 2D Image | 13-Amino-3,15,16-trihydroxy-1,4-dimethoxy-12-methyl-3,4,8a,13-tetrahydro-1H-chromeno[2',3':6,7][1,3]dioxino[4',5',6':4,5]naphtho[2,1-g]isoquinoline-14,17(2H,9H)-dione | C28H26N2O10

13-Amino-3,15,16-trihydroxy-1,4-dimethoxy-12-methyl-3,4,8a,13-tetrahydro-1H-chromeno[2',3':6,7][1,3]dioxino[4',5',6':4,5]naphtho[2,1-g]isoquinoline-14,17(2H,9H)-dione

  • Molecular FormulaC28H26N2O10
  • Average mass550.513 Da
  • Monoisotopic mass550.158752 Da
  • ChemSpider ID4591064

More details:

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

13-Amino-3,15,16-trihydroxy-1,4-dimethoxy-12-methyl-3,4,8a,13-tetrahydro-1H-chromeno[2',3':6,7][1,3]dioxino[4',5',6':4,5]naphtho[2,1-g]isochinolin-14,17(2H,9H)-dion [German] [ACD/IUPAC Name]
13-Amino-3,15,16-trihydroxy-1,4-dimethoxy-12-methyl-3,4,8a,13-tetrahydro-1H-chromeno[2',3':6,7][1,3]dioxino[4',5',6':4,5]naphtho[2,1-g]isoquinoline-14,17(2H,9H)-dione [ACD/IUPAC Name]
13-Amino-3,15,16-trihydroxy-1,4-diméthoxy-12-méthyl-3,4,8a,13-tétrahydro-1H-chroméno[2',3':6,7][1,3]dioxino[4',5',6':4,5]naphto[2,1-g]isoquinoléine-14,17(2H,9H)-dione [French] [ACD/IUPAC Name]
1H-[1]Benzopyrano[2',3':6,7][1,3]dioxino[4',5',6':4,5]naphth[2,1-g]isoquinoline-14,17(2H,9H)-dione, 13-amino-3,4,8a,13-tetrahydro-3,15,16-trihydroxy-1,4-dimethoxy-12-methyl- [ACD/Index Name]
116200-80-7 [RN]
1H-Xantheno(4',3',2':4,5)(1,3)benzodioxino(7,6-g)isoquinoline-14,17(2H,9H)-dione, 13-amino-3,4,8a,13-tetrahydro-3,15,16-trihydroxy-1,4-dimethoxy-12-methyl-, (1S-(1α,3α,4β,8aα))-
Actinoplanone C

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

Density: 1.7±0.1 g/cm3
Boiling Point: 877.6±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 133.6±3.0 kJ/mol
Flash Point: 484.6±37.1 °C
Index of Refraction: 1.768
Molar Refractivity: 135.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 3
ACD/LogP: 0.86
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 20.85
ACD/KOC (pH 5.5): 296.42
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 1.20
ACD/KOC (pH 7.4): 17.10
Polar Surface Area: 170 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 99.3±5.0 dyne/cm
Molar Volume: 326.3±5.0 cm3

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