ChemSpider 2D Image | 2-[(5-Hydroxy-6-methoxy-2-[(4a,6a,7,10-tetramethyl-2,3,4,4a,4b,5,6,6a,6b,7,7a,8,9,10,11,12a,13,13a,13b,14-icosahydro-1H-naphtho[2',1':4,5]indeno[1,2-b]indolizin-2-yl)oxy]-4-{[3,4,5-trihydroxy-6-(hydro xymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-3-yl)oxy]-6-methyltetrahydro-2H-pyran-3,4,5-triol | C45H73NO15

2-[(5-Hydroxy-6-methoxy-2-[(4a,6a,7,10-tetramethyl-2,3,4,4a,4b,5,6,6a,6b,7,7a,8,9,10,11,12a,13,13a,13b,14-icosahydro-1H-naphtho[2',1':4,5]indeno[1,2-b]indolizin-2-yl)oxy]-4-{[3,4,5-trihydroxy-6-(hydro xymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-3-yl)oxy]-6-methyltetrahydro-2H-pyran-3,4,5-triol

  • Molecular FormulaC45H73NO15
  • Average mass868.059 Da
  • Monoisotopic mass867.498047 Da
  • ChemSpider ID513982

More details:

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

2-[(5-Hydroxy-6-methoxy-2-[(4a,6a,7,10-tetramethyl-2,3,4,4a,4b,5,6,6a,6b,7,7a,8,9,10,11,12a,13,13a,13b,14-icosahydro-1H-naphtho[2',1':4,5]indeno[1,2-b]indolizin-2-yl)oxy]-4-{[3,4,5-trihydroxy-6-(hydro xymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-3-yl)oxy]-6-methyltetrahydro-2H-pyran-3,4,5-triol [ACD/IUPAC Name]
2-[(5-Hydroxy-6-methoxy-2-[(4a,6a,7,10-tetramethyl-2,3,4,4a,4b,5,6,6a,6b,7,7a,8,9,10,11,12a,13,13a,13b,14-icosahydro-1H-naphtho[2',1':4,5]indeno[1,2-b]indolizin-2-yl)oxy]-4-{[3,4,5-trihydroxy-6-(hydro xymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-3-yl)oxy]-6-methyltetrahydro-2H-pyran-3,4,5-triol [German] [ACD/IUPAC Name]
2-[(5-Hydroxy-6-méthoxy-2-[(4a,6a,7,10-tétraméthyl-2,3,4,4a,4b,5,6,6a,6b,7,7a,8,9,10,11,12a,13,13a,13b,14-icosahydro-1H-naphto[2',1':4,5]indéno[1,2-b]indolizin-2-yl)oxy]-4-{[3,4,5-trihydroxy-6-(hydrox yméthyl)tétrahydro-2H-pyran-2-yl]oxy}tétrahydro-2H-pyran-3-yl)oxy]-6-méthyltétrahydro-2H-pyrane-3,4,5-triol [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.621
Molar Refractivity: 219.6±0.4 cm3
#H bond acceptors: 16
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 4
ACD/LogP: 6.65
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 2.35
ACD/KOC (pH 5.5): 8.42
ACD/LogD (pH 7.4): 1.80
ACD/BCF (pH 7.4): 2.54
ACD/KOC (pH 7.4): 9.14
Polar Surface Area: 230 Å2
Polarizability: 87.0±0.5 10-24cm3
Surface Tension: 69.1±5.0 dyne/cm
Molar Volume: 624.4±5.0 cm3

Click to predict properties on the Chemicalize site


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