ChemSpider 2D Image | Carbenoxolone | C34H50O7

Carbenoxolone

  • Molecular FormulaC34H50O7
  • Average mass570.757 Da
  • Monoisotopic mass570.355652 Da
  • ChemSpider ID552190
  • defined stereocentres - 9 of 9 defined stereocentres


More details:



Featured data source



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

(3b,20b)-3-(3-Carboxy-1-oxopropoxy)-11-oxoolean-12-en-29-oic Acid
(3β)-3-[(3-Carboxypropanoyl)oxy]-11-oxoolean-12-en-30-oic acid [ACD/IUPAC Name]
(3β)-3-[(3-Carboxypropanoyl)oxy]-11-oxoolean-12-en-30-säure [German] [ACD/IUPAC Name]
1789
18b-Glycyrrhetic Acid Hydrogen Succinate
18β-glycyrrhetic acid hydrogen succinate
227-174-2 [EINECS]
3b-Hydroxy-11-oxoolean-12-en-30-oic Acid Hydrogen Succinate
3-O-(b-Carboxypropionyl)-11-oxo-18b-olean-12-en-30-oic Acid
3-β-(3-Carboxypropionyloxy)-11-oxo-olean-12-en-30-oic acid
More...

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

MM6384NG73 [DBID]
Prestwick0_000837 [DBID]
Prestwick1_000837 [DBID]
SPBio_002714 [DBID]
UNII:MM6384NG73 [DBID]
UNII-MM6384NG73 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 687.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.6 mmHg at 25°C
Enthalpy of Vaporization: 109.8±6.0 kJ/mol
Flash Point: 211.6±25.0 °C
Index of Refraction: 1.562
Molar Refractivity: 154.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 7.08
ACD/LogD (pH 5.5): 4.94
ACD/BCF (pH 5.5): 1121.74
ACD/KOC (pH 5.5): 1444.80
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 2.21
ACD/KOC (pH 7.4): 2.85
Polar Surface Area: 118 Å2
Polarizability: 61.1±0.5 10-24cm3
Surface Tension: 51.4±5.0 dyne/cm
Molar Volume: 475.5±5.0 cm3

Click to predict properties on the Chemicalize site





Feedback Form