ChemSpider 2D Image | (5xi,23S,24E)-23-Hydroxy-3,7,11,15-tetraoxolanosta-8,24-dien-26-oic acid | C30H40O7

(5ξ,23S,24E)-23-Hydroxy-3,7,11,15-tetraoxolanosta-8,24-dien-26-oic acid

  • Molecular FormulaC30H40O7
  • Average mass512.634 Da
  • Monoisotopic mass512.277405 Da
  • ChemSpider ID54868871

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(5ξ,23S,24E)-23-Hydroxy-3,7,11,15-tetraoxolanosta-8,24-dien-26-oic acid [ACD/IUPAC Name]
(5ξ,23S,24E)-23-Hydroxy-3,7,11,15-tetraoxolanosta-8,24-dien-26-säure [German] [ACD/IUPAC Name]
Acide (5ξ,23S,24E)-23-hydroxy-3,7,11,15-tétraoxolanosta-8,24-dién-26-oïque [French] [ACD/IUPAC Name]
Lanosta-8,24-dien-26-oic acid, 23-hydroxy-3,7,11,15-tetraoxo-, (5ξ,23S,24E)- [ACD/Index Name]
(E,4S,6R)-4-hydroxy-2-methyl-6-[(10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3,7,11,15-tetraoxo-2,5,6,12,16,17-hexahydro-1H-cyclopenta[a]phenanthren-17-yl]hept-2-enoic acid
1085273-49-9 [RN]
23S-hydroxyl-11,15-dioxo-ganoderic-acid-DM
PILMPTUAXYPAME-ICXXFQCZSA-N

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

Density: 1.2±0.1 g/cm3
Boiling Point: 700.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 117.2±6.0 kJ/mol
Flash Point: 391.3±29.4 °C
Index of Refraction: 1.570
Molar Refractivity: 135.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 3.31
ACD/LogD (pH 5.5): 2.10
ACD/BCF (pH 5.5): 12.93
ACD/KOC (pH 5.5): 108.82
ACD/LogD (pH 7.4): 0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.72
Polar Surface Area: 126 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 53.1±5.0 dyne/cm
Molar Volume: 413.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement