ChemSpider 2D Image | (3beta,12beta,20E)-12-Hydroxydammara-20(22),24-dien-3-yl beta-D-glucopyranoside | C36H60O7

(3β,12β,20E)-12-Hydroxydammara-20(22),24-dien-3-yl β-D-glucopyranoside

  • Molecular FormulaC36H60O7
  • Average mass604.857 Da
  • Monoisotopic mass604.433899 Da
  • ChemSpider ID57620804

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 14 of 14 defined stereocentres

More details:

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

(3β,12β,20E)-12-Hydroxydammara-20(22),24-dien-3-yl β-D-glucopyranoside [ACD/IUPAC Name]
(3β,12β,20E)-12-Hydroxydammara-20(22),24-dien-3-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de (3β,12β,20E)-12-hydroxydammara-20(22),24-dién-3-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (3β,12β,20E)-12-hydroxydammara-20(22),24-dien-3-yl [ACD/Index Name]
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(3S,5R,8R,9R,10R,12R,13R,14R,17S)-12-hydroxy-4,4,8,10,14-pentamethyl-17-[(2E)-6-methylhepta-2,5-dien-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol
166040-90-0 [RN]
219712-86-4 [RN]
Ginsenoside Rh3
Isoginsenoside Rh3

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

Density: 1.2±0.1 g/cm3
Boiling Point: 695.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 116.4±6.0 kJ/mol
Flash Point: 374.1±31.5 °C
Index of Refraction: 1.570
Molar Refractivity: 168.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 7.10
ACD/LogD (pH 5.5): 5.25
ACD/BCF (pH 5.5): 5752.49
ACD/KOC (pH 5.5): 17096.09
ACD/LogD (pH 7.4): 5.25
ACD/BCF (pH 7.4): 5752.45
ACD/KOC (pH 7.4): 17095.98
Polar Surface Area: 120 Å2
Polarizability: 66.9±0.5 10-24cm3
Surface Tension: 51.8±5.0 dyne/cm
Molar Volume: 514.7±5.0 cm3

Click to predict properties on the Chemicalize site


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