2-O-Sulfo-L-Iduronic Acid

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Properties Simple | Detailed

Formula C6H10O10S
IUPAC Name (2r,3s,4s,5r)-2,3,4-trihydroxy-6-oxo-5-sulfooxy-hexanoic acid
Molecular Mass 274.203 g·mol−1
Heat of Formation -1781.3 ± 16.7 kJ·mol−1
Dipole Moment 5.31 ± 1.08 D
Volume 265.85 Å 3
Surface Area 233.98 Å 2
HOMO Energy -10.48 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4s,5r)-2,3,4-trihydroxy-6-keto-5-sulfoxy-hexanoic acid
  • (2r,3s,4s,5r)-2,3,4-trihydroxy-6-oxo-5-sulfooxy-hexanoic acid
  • (2r,3s,4s,5r)-2,3,4-trihydroxy-6-oxo-5-sulfooxyhexanoic acid
  • iduronate 2-sulphate
  • l-iduronic acid 2-sulfate
  • l-iduronic acid, 2-(hydrogen sulfate)
CAS Number(s)
  • 89846-17-3
InChIKey PURMPUDWXOWORS-SKNVOMKLSA-N
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