ChemSpider 2D Image | (3beta,5alpha,25R)-Spirostan-3-yl beta-D-glucopyranosyl-(1->2)-[beta-D-xylopyranosyl-(1->3)]-beta-D-glucopyranosyl-(1->3)-alpha-D-galactopyranoside | C50H82O22

(3β,5α,25R)-Spirostan-3-yl β-D-glucopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-β-D-glucopyranosyl-(1->3)-α-D-galactopyranoside

  • Molecular FormulaC50H82O22
  • Average mass1035.173 Da
  • Monoisotopic mass1034.529785 Da
  • ChemSpider ID44750356

  • defined stereocentres - 31 of 31 defined stereocentres

More details:

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

(3β,5α,25R)-Spirostan-3-yl β-D-glucopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-β-D-glucopyranosyl-(1->3)-α-D-galactopyranoside [ACD/IUPAC Name]
(3β,5α,25R)-Spirostan-3-yl-β-D-glucopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-β-D-glucopyranosyl-(1->3)-α-D-galactopyranosid [German] [ACD/IUPAC Name]
α-D-Galactopyranoside, (3β,5α,25R)-spirostan-3-yl O-β-D-glucopyranosyl-(1->2)-O-[β-D-xylopyranosyl-(1->3)]-O-β-D-glucopyranosyl-(1->3)- [ACD/Index Name]
β-D-Glucopyranosyl-(1->2)-[β-D-xylopyranosyl-(1->3)]-β-D-glucopyranosyl-(1->3)-α-D-galactopyranoside de (3β,5α,25R)-spirostan-3-yle [French] [ACD/IUPAC Name]
(3?,9?,14?,17?,20?,22?)-Spirostan-3-ylD-erythro-hexopyranosyl-(1->2)-[(3?)-D-erythro-pentopyranosyl-(1->3)]-D-erythro-hexopyranosyl- (1->4)-D-erythro-hexopyranoside
39941-51-0 [RN]
Degalactotigonin
UttroninA

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

    Density: 1.5±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.634
    Molar Refractivity: 248.4±0.4 cm3
    #H bond acceptors: 22
    #H bond donors: 12
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 3
    ACD/LogP: 4.02
    ACD/LogD (pH 5.5): 2.56
    ACD/BCF (pH 5.5): 51.61
    ACD/KOC (pH 5.5): 585.24
    ACD/LogD (pH 7.4): 2.56
    ACD/BCF (pH 7.4): 51.61
    ACD/KOC (pH 7.4): 585.24
    Polar Surface Area: 335 Å2
    Polarizability: 98.5±0.5 10-24cm3
    Surface Tension: 80.0±5.0 dyne/cm
    Molar Volume: 694.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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