ChemSpider 2D Image | (2S,3S)-4-[(2R,3S,4S)-3,4-Dihydroxy-2-(hydroxymethyl)tetrahydro-1-thiopheniumyl]-1,3-dihydroxy-2-butanyl sulfate | C9H18O9S2

(2S,3S)-4-[(2R,3S,4S)-3,4-Dihydroxy-2-(hydroxymethyl)tetrahydro-1-thiopheniumyl]-1,3-dihydroxy-2-butanyl sulfate

  • Molecular FormulaC9H18O9S2
  • Average mass334.364 Da
  • Monoisotopic mass334.039215 Da
  • ChemSpider ID25030896

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(2S,3S)-4-[(2R,3S,4S)-3,4-Dihydroxy-2-(hydroxymethyl)tetrahydro-1-thiopheniumyl]-1,3-dihydroxy-2-butanyl sulfate [ACD/IUPAC Name]
(2S,3S)-4-[(2R,3S,4S)-3,4-Dihydroxy-2-(hydroxymethyl)tetrahydro-1-thiopheniumyl]-1,3-dihydroxy-2-butanylsulfat [German] [ACD/IUPAC Name]
Sulfate de (2S,3S)-4-[(2R,3S,4S)-3,4-dihydroxy-2-(hydroxyméthyl)tétrahydro-1-thiophéniumyl]-1,3-dihydroxy-2-butanyle [French] [ACD/IUPAC Name]
(1S,2R,3S,4S)-1-[(2S,3S)-2,4-Dihydroxy-3-(sulfooxy)butyl]tetrahydro-3,4-dihydroxy-2-(hydroxymethyl)thiophenium inner salt
(2S,3S)-4-((1S,2R,3S,4S)-3,4-dihydroxy-2-(Hydroxymethyl)tetrahydro-1h-thiophen-1-ium-1-yl)-1,3-dihydroxybutan-2-yl sulfate
1,4-Dideoxy-1,4-[(S)-[(2S,3S)-2,4-dihydroxy-3-(sulfooxy)butyl]episulfoniumylidene]-D-arabinitol inner salt
200399-47-9 [RN]
MFCD28009649
SALACINOL

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

Density:
Boiling Point:
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Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 7
#Rule of 5 Violations:
ACD/LogP:
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: 176 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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