ChemSpider 2D Image | GANOLUCIDIC ACID D | C30H44O6

GANOLUCIDIC ACID D

  • Molecular FormulaC30H44O6
  • Average mass500.667 Da
  • Monoisotopic mass500.313782 Da
  • ChemSpider ID58828535

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(15α,23S,24E)-15,23-Dihydroxy-3,11-dioxolanosta-8,24-dien-26-oic acid [ACD/IUPAC Name]
(15α,23S,24E)-15,23-Dihydroxy-3,11-dioxolanosta-8,24-dien-26-säure [German] [ACD/IUPAC Name]
102607-22-7 [RN]
Acide (15α,23S,24E)-15,23-dihydroxy-3,11-dioxolanosta-8,24-dién-26-oïque [French] [ACD/IUPAC Name]
GANOLUCIDIC ACID D
Lanosta-8,24-dien-26-oic acid, 15,23-dihydroxy-3,11-dioxo-, (15α,23S,24E)- [ACD/Index Name]
(+)-Ganolucidic acid D
(2E,4S,6R)-4-hydroxy-6-[(1R,3S,3aR,5aR,9aS,11aR)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-7,10-dioxo-2,3,3a,4,5,5a,6,7,8,9,9a,10,11,11a-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid
(E,4S,6R)-4-hydroxy-6-[(5R,10S,13R,14R,15S,17R)-15-hydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid

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

NJ101O0321 [DBID]
UNII:NJ101O0321 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 679.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.1±6.0 kJ/mol
Flash Point: 378.8±28.0 °C
Index of Refraction: 1.569
Molar Refractivity: 136.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 3.99
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 59.09
ACD/KOC (pH 5.5): 323.80
ACD/LogD (pH 7.4): 1.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.11
Polar Surface Area: 112 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 51.8±5.0 dyne/cm
Molar Volume: 417.3±5.0 cm3

Click to predict properties on the Chemicalize site


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