ChemSpider 2D Image | (3beta,5xi,7beta,15alpha,20E)-3,7,15,24-Tetrahydroxy-11,23-dioxolanosta-8,20(22)-dien-26-oic acid | C30H44O8

(3β,5ξ,7β,15α,20E)-3,7,15,24-Tetrahydroxy-11,23-dioxolanosta-8,20(22)-dien-26-oic acid

  • Molecular FormulaC30H44O8
  • Average mass532.666 Da
  • Monoisotopic mass532.303589 Da
  • ChemSpider ID78445649

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 10 defined stereocentres

More details:

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

(3β,5ξ,7β,15α,20E)-3,7,15,24-Tetrahydroxy-11,23-dioxolanosta-8,20(22)-dien-26-oic acid [ACD/IUPAC Name]
(3β,5ξ,7β,15α,20E)-3,7,15,24-Tetrahydroxy-11,23-dioxolanosta-8,20(22)-dien-26-säure [German] [ACD/IUPAC Name]
Acide (3β,5ξ,7β,15α,20E)-3,7,15,24-tétrahydroxy-11,23-dioxolanosta-8,20(22)-dién-26-oïque [French] [ACD/IUPAC Name]
Lanosta-8,20(22)-dien-26-oic acid, 3,7,15,24-tetrahydroxy-11,23-dioxo-, (3β,5ξ,7β,15α,20E)- [ACD/Index Name]
Resinacein N

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

Density: 1.3±0.1 g/cm3
Boiling Point: 719.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.3 mmHg at 25°C
Enthalpy of Vaporization: 120.0±6.0 kJ/mol
Flash Point: 402.7±29.4 °C
Index of Refraction: 1.592
Molar Refractivity: 139.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 1.34
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 1.54
ACD/KOC (pH 5.5): 19.08
ACD/LogD (pH 7.4): -0.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 152 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 60.0±5.0 dyne/cm
Molar Volume: 413.0±5.0 cm3

Click to predict properties on the Chemicalize site


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