Found 1 result

Search term: 23311645 (Found by CSID)
ChemSpider 2D Image | (5beta,6beta,7alpha,8alpha,9beta,10alpha,11alpha)-6,7,11-Trihydroxy-15-oxo-7,20-epoxykaur-16-en-18-yl acetate | C22H30O7

(5β,6β,7α,8α,9β,10α,11α)-6,7,11-Trihydroxy-15-oxo-7,20-epoxykaur-16-en-18-yl acetate

  • Molecular FormulaC22H30O7
  • Average mass406.469 Da
  • Monoisotopic mass406.199158 Da
  • ChemSpider ID23311645

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(5β,6β,7α,8α,9β,10α,11α)-6,7,11-Trihydroxy-15-oxo-7,20-epoxykaur-16-en-18-yl acetate [ACD/IUPAC Name]
(5β,6β,7α,8α,9β,10α,11α)-6,7,11-Trihydroxy-15-oxo-7,20-epoxykaur-16-en-18-yl-acetat [German] [ACD/IUPAC Name]
Acétate de (5β,6β,7α,8α,9β,10α,11α)-6,7,11-trihydroxy-15-oxo-7,20-époxykaur-16-én-18-yle [French] [ACD/IUPAC Name]
longikaurin D

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

Density: 1.4±0.1 g/cm3
Boiling Point: 586.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 100.6±6.0 kJ/mol
Flash Point: 203.3±23.6 °C
Index of Refraction: 1.607
Molar Refractivity: 101.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.10
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 8.80
ACD/KOC (pH 5.5): 165.06
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 8.80
ACD/KOC (pH 7.4): 165.03
Polar Surface Area: 113 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 62.6±5.0 dyne/cm
Molar Volume: 293.8±5.0 cm3

Click to predict properties on the Chemicalize site


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