ChemSpider 2D Image | (3beta,16beta,23R)-3-{[4-O-(6-Deoxy-beta-D-gulopyranosyl)-alpha-L-lyxopyranosyl]oxy}-16,23:16,30-diepoxydammar-24-en-20-yl 2,3-di-O-acetyl-6-deoxy-beta-D-gulopyranoside | C51H80O18

(3β,16β,23R)-3-{[4-O-(6-Deoxy-β-D-gulopyranosyl)-α-L-lyxopyranosyl]oxy}-16,23:16,30-diepoxydammar-24-en-20-yl 2,3-di-O-acetyl-6-deoxy-β-D-gulopyranoside

  • Molecular FormulaC51H80O18
  • Average mass981.170 Da
  • Monoisotopic mass980.534485 Da
  • ChemSpider ID390526
  • defined stereocentres - 25 of 25 defined stereocentres


More details:






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

(3β,16β,23R)-3-{[4-O-(6-Deoxy-β-D-gulopyranosyl)-α-L-lyxopyranosyl]oxy}-16,23:16,30-diepoxydammar-24-en-20-yl 2,3-di-O-acetyl-6-deoxy-β-D-gulopyranoside [ACD/IUPAC Name]
(3β,16β,23R)-3-{[4-O-(6-Desoxy-β-D-gulopyranosyl)-α-L-lyxopyranosyl]oxy}-16,23:16,30-diepoxydammar-24-en-20-yl-2,3-di-O-acetyl-6-desoxy-β-D-gulopyranosid [German] [ACD/IUPAC Name]
2,3-Di-O-acétyl-6-désoxy-β-D-gulopyranoside de (3β,16β,23R)-3-{[4-O-(6-désoxy-β-D-gulopyranosyl)-α-L-lyxopyranosyl]oxy}-16,23:16,30-diépoxydammar-24-én-20-yle [French] [ACD/IUPAC Name]
β-D-Gulopyranoside, (3β,16β,23R)-3-[[4-O-(6-deoxy-β-D-gulopyranosyl)-α-L-lyxopyranosyl]oxy]-16,23:16,30-diepoxydammar-24-en-20-yl 6-deoxy-, 2,3-diacetate [ACD/Index Name]
73667-51-3 [RN]
Ziziphin

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

C08991 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.589
Molar Refractivity: 246.0±0.4 cm3
#H bond acceptors: 18
#H bond donors: 6
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 4
ACD/LogP: 6.59
ACD/LogD (pH 5.5): 5.65
ACD/BCF (pH 5.5): 11614.69
ACD/KOC (pH 5.5): 28269.70
ACD/LogD (pH 7.4): 5.65
ACD/BCF (pH 7.4): 11614.53
ACD/KOC (pH 7.4): 28269.29
Polar Surface Area: 248 Å2
Polarizability: 97.5±0.5 10-24cm3
Surface Tension: 61.6±5.0 dyne/cm
Molar Volume: 729.7±5.0 cm3

Click to predict properties on the Chemicalize site





Feedback Form