Found 1 result

Search term: 8593215 (Found by CSID)
ChemSpider 2D Image | 1,4,17,18-Tetrahydroxy-3-({5-[(5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-6-methyltetrahydro-2H-pyran-2-yl}oxy)-11a-methyl-1,2,3,4,8a,9,11,11a,13,14-decahydrochromeno[2',3':6,7][1,3]dioxino[4',5' ,6':4,5]naphtho[2,1-g][1,3]oxazolo[3,2-b]isoquinoline-16,19-dione | C40H45NO15

1,4,17,18-Tetrahydroxy-3-({5-[(5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-6-methyltetrahydro-2H-pyran-2-yl}oxy)-11a-methyl-1,2,3,4,8a,9,11,11a,13,14-decahydrochromeno[2',3':6,7][1,3]dioxino[4',5' ,6':4,5]naphtho[2,1-g][1,3]oxazolo[3,2-b]isoquinoline-16,19-dione

  • Molecular FormulaC40H45NO15
  • Average mass779.783 Da
  • Monoisotopic mass779.278931 Da
  • ChemSpider ID8593215

More details:

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

[1]Benzopyrano[2',3':6,7][1,3]dioxino[4',5',6':4,5]naphth[2,1-g]oxazolo[3,2-b]isoquinoline-16,19-dione, 1,2,3,4,8a,9,11,11a,13,14-decahydro-1,4,17,18-tetrahydroxy-11a-methyl-3-[[tetrahydro-6-methyl-5- [(tetrahydro-5-hydroxy-6-methyl-2H-pyran-2-yl)oxy]-2H-pyran-2-yl]oxy]- [ACD/Index Name]
1,4,17,18-Tetrahydroxy-3-({5-[(5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-6-methyltetrahydro-2H-pyran-2-yl}oxy)-11a-methyl-1,2,3,4,8a,9,11,11a,13,14-decahydrochromeno[2',3':6,7][1,3]dioxino[4',5' ,6':4,5]naphtho[2,1-g][1,3]oxazolo[3,2-b]isochinolin-16,19-dion [German] [ACD/IUPAC Name]
1,4,17,18-Tetrahydroxy-3-({5-[(5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-6-methyltetrahydro-2H-pyran-2-yl}oxy)-11a-methyl-1,2,3,4,8a,9,11,11a,13,14-decahydrochromeno[2',3':6,7][1,3]dioxino[4',5' ,6':4,5]naphtho[2,1-g][1,3]oxazolo[3,2-b]isoquinoline-16,19-dione [ACD/IUPAC Name]
1,4,17,18-Tétrahydroxy-3-({5-[(5-hydroxy-6-méthyltétrahydro-2H-pyran-2-yl)oxy]-6-méthyltétrahydro-2H-pyran-2-yl}oxy)-11a-méthyl-1,2,3,4,8a,9,11,11a,13,14-décahydrochroméno[2',3':6,7][1,3]dioxino[4',5' ,6':4,5]naphto[2,1-g][1,3]oxazolo[3,2-b]isoquinoléine-16,19-dione [French] [ACD/IUPAC Name]
Kigamicin B

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.717
Molar Refractivity: 189.7±0.4 cm3
#H bond acceptors: 16
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 0.34
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 9.57
ACD/KOC (pH 5.5): 167.15
ACD/LogD (pH 7.4): 0.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.74
Polar Surface Area: 212 Å2
Polarizability: 75.2±0.5 10-24cm3
Surface Tension: 91.1±5.0 dyne/cm
Molar Volume: 481.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement