Found 6 results

Search term: BCUDKRWNGQAFLF (Found by InChIKey (skeleton match))
ChemSpider 2D Image | IN00282 | C45H74O17

IN00282

  • Molecular FormulaC45H74O17
  • Average mass887.059 Da
  • Monoisotopic mass886.492615 Da
  • ChemSpider ID64870711

  • defined stereocentres - 27 of 27 defined stereocentres

More details:

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

(3β,5α,8α,25S)-Spirostan-3-yl β-L-allopyranosyl-(1->2)-[6-deoxy-β-D-idopyranosyl-(1->4)]-α-L-gulopyranoside [ACD/IUPAC Name]
(3β,5α,8α,25S)-Spirostan-3-yl-β-L-allopyranosyl-(1->2)-[6-desoxy-β-D-idopyranosyl-(1->4)]-α-L-gulopyranosid [German] [ACD/IUPAC Name]
IN00282
α-L-Gulopyranoside, (3β,5α,8α,25S)-spirostan-3-yl O-β-L-allopyranosyl-(1->;2)-O-[6-deoxy-β-D-idopyranosyl-(1->;4)]- [ACD/Index Name]
β-L-Allopyranosyl-(1->2)-[6-désoxy-β-D-idopyranosyl-(1->4)]-α-L-gulopyranoside de (3β,5α,8α,25S)-spirostan-3-yle [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.615
Molar Refractivity: 219.3±0.4 cm3
#H bond acceptors: 17
#H bond donors: 9
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 159.65
ACD/KOC (pH 5.5): 1313.29
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 159.65
ACD/KOC (pH 7.4): 1313.29
Polar Surface Area: 256 Å2
Polarizability: 86.9±0.5 10-24cm3
Surface Tension: 70.9±5.0 dyne/cm
Molar Volume: 628.5±5.0 cm3

Click to predict properties on the Chemicalize site


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