Found 29 results

Search term: MF = 'C_{34}H_{48}O_{12}'
ChemSpider 2D Image | (3beta,15alpha,22R)-15,17-Dihydroxy-1,26-dioxo-14,20:22,26-diepoxyergosta-5,24-dien-3-yl beta-D-glucopyranoside | C34H48O12

(3β,15α,22R)-15,17-Dihydroxy-1,26-dioxo-14,20:22,26-diepoxyergosta-5,24-dien-3-yl β-D-glucopyranoside

  • Molecular FormulaC34H48O12
  • Average mass648.738 Da
  • Monoisotopic mass648.314575 Da
  • ChemSpider ID8851084

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

(3β,15α,22R)-15,17-Dihydroxy-1,26-dioxo-14,20:22,26-diepoxyergosta-5,24-dien-3-yl β-D-glucopyranoside [ACD/IUPAC Name]
(3β,15α,22R)-15,17-Dihydroxy-1,26-dioxo-14,20:22,26-diepoxyergosta-5,24-dien-3-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
Ergosta-5,24-diene-1,26-dione, 14,20:22,26-diepoxy-3-(β-D-glucopyranosyloxy)-15,17-dihydroxy-, (3β,15α,22R)- [ACD/Index Name]
β-D-Glucopyranoside de (3β,15α,22R)-15,17-dihydroxy-1,26-dioxo-14,20:22,26-diépoxyergosta-5,24-dién-3-yle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 867.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 143.3±6.0 kJ/mol
Flash Point: 274.1±27.8 °C
Index of Refraction: 1.637
Molar Refractivity: 160.6±0.4 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: -0.12
ACD/LogD (pH 5.5): 0.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 23.97
ACD/LogD (pH 7.4): 0.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 23.97
Polar Surface Area: 192 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 72.5±5.0 dyne/cm
Molar Volume: 447.2±5.0 cm3

Click to predict properties on the Chemicalize site


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