ChemSpider 2D Image | (2S,3S,4R,5S)-1-[(2R,3S,4S)-3,4-Dihydroxy-2-(hydroxymethyl)tetrahydro-1-thiopheniumyl]-2,4,5,6-tetrahydroxy-3-hexanyl sulfate | C11H22O11S2

(2S,3S,4R,5S)-1-[(2R,3S,4S)-3,4-Dihydroxy-2-(hydroxymethyl)tetrahydro-1-thiopheniumyl]-2,4,5,6-tetrahydroxy-3-hexanyl sulfate

  • Molecular FormulaC11H22O11S2
  • Average mass394.416 Da
  • Monoisotopic mass394.060364 Da
  • ChemSpider ID26365429
  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(2S,3S,4R,5S)-1-[(2R,3S,4S)-3,4-Dihydroxy-2-(hydroxymethyl)tetrahydro-1-thiopheniumyl]-2,4,5,6-tetrahydroxy-3-hexanyl sulfate [ACD/IUPAC Name]
(2S,3S,4R,5S)-1-[(2R,3S,4S)-3,4-Dihydroxy-2-(hydroxymethyl)tetrahydro-1-thiopheniumyl]-2,4,5,6-tetrahydroxy-3-hexanylsulfat [German] [ACD/IUPAC Name]
Sulfate de (2S,3S,4R,5S)-1-[(2R,3S,4S)-3,4-dihydroxy-2-(hydroxyméthyl)tétrahydro-1-thiophéniumyl]-2,4,5,6-tétrahydroxy-3-hexanyle [French] [ACD/IUPAC Name]

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

Boiling Point:
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Enthalpy of Vaporization:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 8
#Freely Rotating Bonds: 9
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 216 Å2
Surface Tension:
Molar Volume:

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