ChemSpider 2D Image | (1beta,3beta,24S,25S)-3,24-Dihydroxyspirost-5-en-1-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-L-arabinopyranoside | C38H60O13

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

  • Molecular FormulaC38H60O13
  • Average mass724.875 Da
  • Monoisotopic mass724.403381 Da
  • ChemSpider ID9356789

  • defined stereocentres - 22 of 22 defined stereocentres

More details:

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

(1β,3β,24S,25S)-3,24-Dihydroxyspirost-5-en-1-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranoside [ACD/IUPAC Name]
(1β,3β,24S,25S)-3,24-Dihydroxyspirost-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,24S,25S)-3,24-dihydroxyspirost-5-én-1-yle [French] [ACD/IUPAC Name]
α-L-Arabinopyranoside, (1β,3β,24S,25S)-3,24-dihydroxyspirost-5-en-1-yl 2-O-(6-deoxy-α-L-mannopyranosyl)- [ACD/Index Name]
24S,25S)-3[β],24-dihydroxyspirost-5-en-1[β]-yl O-[α]- L-rhamnospyranosyl-(1[to]2)-[α]-L-arabinopyranoside
790661-47-1 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 876.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 144.7±6.0 kJ/mol
Flash Point: 483.9±34.3 °C
Index of Refraction: 1.618
Molar Refractivity: 182.1±0.4 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 188.92
ACD/KOC (pH 5.5): 1482.40
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 188.92
ACD/KOC (pH 7.4): 1482.38
Polar Surface Area: 197 Å2
Polarizability: 72.2±0.5 10-24cm3
Surface Tension: 68.0±5.0 dyne/cm
Molar Volume: 519.6±5.0 cm3

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