Found 19 results

Search term: MF = 'C_{26}H_{38}O_{11}'
ChemSpider 2D Image | (1S,4aR,7R)-4-Formyl-4a-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl 2-O-[(2E,6E)-8-hydroxy-2,6-dimethyl-2,6-octadienoyl]-beta-D-glucopyranoside | C26H38O11

(1S,4aR,7R)-4-Formyl-4a-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl 2-O-[(2E,6E)-8-hydroxy-2,6-dimethyl-2,6-octadienoyl]-β-D-glucopyranoside

  • Molecular FormulaC26H38O11
  • Average mass526.573 Da
  • Monoisotopic mass526.241394 Da
  • ChemSpider ID8545050

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 9 defined stereocentres

More details:

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

(1S,4aR,7R)-4-Formyl-4a-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl 2-O-[(2E,6E)-8-hydroxy-2,6-dimethyl-2,6-octadienoyl]-β-D-glucopyranoside [ACD/IUPAC Name]
(1S,4aR,7R)-4-Formyl-4a-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl-2-O-[(2E,6E)-8-hydroxy-2,6-dimethyl-2,6-octadienoyl]-β-D-glucopyranosid [German] [ACD/IUPAC Name]
2-O-[(2E,6E)-8-Hydroxy-2,6-diméthyl-2,6-octadienoyl]-β-D-glucopyranoside de (1S,4aR,7R)-4-formyl-4a-hydroxy-7-méthyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yle [French] [ACD/IUPAC Name]
Cyclopenta[c]pyran-4-carboxaldehyde, 1,4a,5,6,7,7a-hexahydro-4a-hydroxy-1-[[2-O-[(2E,6E)-8-hydroxy-2,6-dimethyl-1-oxo-2,6-octadien-1-yl]-β-D-glucopyranosyl]oxy]-7-methyl-, (1S,4aR,7R)- [ACD/Index 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: 737.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 122.9±6.0 kJ/mol
Flash Point: 242.3±26.4 °C
Index of Refraction: 1.588
Molar Refractivity: 130.3±0.4 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 1.14
ACD/BCF (pH 5.5): 4.36
ACD/KOC (pH 5.5): 99.79
ACD/LogD (pH 7.4): 1.14
ACD/BCF (pH 7.4): 4.36
ACD/KOC (pH 7.4): 99.79
Polar Surface Area: 172 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 63.9±5.0 dyne/cm
Molar Volume: 387.4±5.0 cm3

Click to predict properties on the Chemicalize site


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