Found 79 results

Search term: MF = 'C_{26}H_{32}O_{10}'
ChemSpider 2D Image | 4-Hydroxy-17-methoxy-10-oxo-2-oxatricyclo[13.2.2.1~3,7~]icosa-1(17),3(20),4,6,15,18-hexaen-9-yl beta-D-glucopyranoside | C26H32O10

4-Hydroxy-17-methoxy-10-oxo-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,15,18-hexaen-9-yl β-D-glucopyranoside

  • Molecular FormulaC26H32O10
  • Average mass504.526 Da
  • Monoisotopic mass504.199554 Da
  • ChemSpider ID8895628

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

2-Oxatricyclo[13.2.2.13,7]eicosa-3,5,7(20),15,17,18-hexaen-10-one, 9-(β-D-glucopyranosyloxy)-4-hydroxy-17-methoxy- [ACD/Index Name]
4-Hydroxy-17-methoxy-10-oxo-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,15,18-hexaen-9-yl β-D-glucopyranoside [ACD/IUPAC Name]
4-Hydroxy-17-methoxy-10-oxo-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,15,18-hexaen-9-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de 4-hydroxy-17-méthoxy-10-oxo-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3(20),4,6,15,18-hexaén-9-yle [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL514388/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 751.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.9±3.0 kJ/mol
Flash Point: 251.9±26.4 °C
Index of Refraction: 1.645
Molar Refractivity: 126.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: -0.35
ACD/LogD (pH 5.5): 0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 31.29
ACD/LogD (pH 7.4): 0.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 30.82
Polar Surface Area: 155 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 75.6±5.0 dyne/cm
Molar Volume: 349.9±5.0 cm3

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