Found 1 result

Search term: IQFWYNFDWRYSRA-BLELIYKESA-N (Found by InChIKey (full match))
ChemSpider 2D Image | S-(5-deoxy-D-ribos-5-yl)-L-homocysteine | C9H17NO6S

S-(5-deoxy-D-ribos-5-yl)-L-homocysteine

  • Molecular FormulaC9H17NO6S
  • Average mass267.299 Da
  • Monoisotopic mass267.077667 Da
  • ChemSpider ID21864833

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

5-S-[(3S)-3-Ammonio-3-carboxylatopropyl]-5-thio-D-ribofuranose [German] [ACD/IUPAC Name]
5-S-[(3S)-3-Ammonio-3-carboxylatopropyl]-5-thio-D-ribofuranose [ACD/IUPAC Name]
5-S-[(3S)-3-Ammonio-3-carboxylatopropyl]-5-thio-D-ribofuranose [French] [ACD/IUPAC Name]
D-Ribofuranose, 5-S-[(3S)-3-amino-3-carboxypropyl]-5-thio- [ACD/Index Name]
S-(5-deoxy-D-ribos-5-yl)-L-homocysteine
5-S-[(3S)-3-azaniumyl-3-carboxylatopropyl]-5-thio-D-ribofuranose
Ribose-5-S-homocysteine
S-(5-deoxy-D-ribofuranos-5-yl)-L-homocysteine
S-(5-deoxy-D-ribos-5-yl)-L-homocysteine zwitterion
  • Miscellaneous

    • Chemical Class:

      Zwitterionic form of <element>S</element>-(5-deoxy-<stereo>D</stereo>-ribos-5-yl)-<stereo>L</stereo>-homocysteine arising from transfer of a proton from the carboxy to the amino group; major species a t pH 7.3. ChEBI CHEBI:17575, CHEBI:58195
      Zwitterionic form of S-(5-deoxy-D-ribos-5-yl)-L-homocysteine arising from transfer of a proton from the carboxy to the amino group; major species a; t pH 7.3. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:58195
      Zwitterionic form of S-(5-deoxy-D-ribos-5-yl)-L-homocysteine arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3. ChEBI CHEBI:58195

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

Density:
Boiling Point: 548.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 95.2±6.0 kJ/mol
Flash Point: 285.5±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.74
ACD/LogD (pH 5.5): -4.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 163 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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