ChemSpider 2D Image | (1beta,3beta,23S,24S,25S)-3,23,24-Trihydroxy-15-oxospirost-5-en-1-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-L-arabinopyranoside | C38H58O15

(1β,3β,23S,24S,25S)-3,23,24-Trihydroxy-15-oxospirost-5-en-1-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranoside

  • Molecular FormulaC38H58O15
  • Average mass754.858 Da
  • Monoisotopic mass754.377563 Da
  • ChemSpider ID57641794
  • defined stereocentres - 23 of 23 defined stereocentres


More details:






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

(1β,3β,23S,24S,25S)-3,23,24-Trihydroxy-15-oxospirost-5-en-1-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranoside [ACD/IUPAC Name]
(1β,3β,23S,24S,25S)-3,23,24-Trihydroxy-15-oxospirost-5-en-1-yl-2-O-(6-desoxy-α-L-mannopyranosyl)-α-L-arabinopyranosid [German] [ACD/IUPAC Name]
2-O-(6-Désoxy-α-L-mannopyranosyl)-α-L-arabinopyranoside de (1β,3β,23S,24S,25S)-3,23,24-trihydroxy-15-oxospirost-5-én-1-yle [French] [ACD/IUPAC Name]
Spirost-5-en-15-one, 1-[[2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]-3,23,24-trihydroxy-, (1β,3β,23S,24S,25S)- [ACD/Index Name]
882661-04-3 [RN]
Ornithosaponin A

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

Density: 1.5±0.1 g/cm3
Boiling Point: 929.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 153.5±6.0 kJ/mol
Flash Point: 283.5±27.8 °C
Index of Refraction: 1.634
Molar Refractivity: 183.8±0.4 cm3
#H bond acceptors: 15
#H bond donors: 8
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 2.55
ACD/LogD (pH 5.5): 1.48
ACD/BCF (pH 5.5): 7.80
ACD/KOC (pH 5.5): 151.38
ACD/LogD (pH 7.4): 1.48
ACD/BCF (pH 7.4): 7.80
ACD/KOC (pH 7.4): 151.38
Polar Surface Area: 234 Å2
Polarizability: 72.9±0.5 10-24cm3
Surface Tension: 74.8±5.0 dyne/cm
Molar Volume: 514.0±5.0 cm3

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