Cas no 38029-84-4 (a-D-Psicopyranose)

a-D-Psicopyranose structure
a-D-Psicopyranose structure
Product Name:a-D-Psicopyranose
CAS No:38029-84-4
MF:C6H12O6
MW:180.155882835388
CID:320861
PubChem ID:10130221
Update Time:2025-04-19

a-D-Psicopyranose Chemical and Physical Properties

Names and Identifiers

    • a-D-Psicopyranose
    • 38029-84-4
    • Web
    • alpha-D-Psicopyranose
    • UNII-MPP56UF5I7
    • .ALPHA.-D-PSICOPYRANOSE
    • (2~{S},3~{R},4~{R},5~{R})-2-(hydroxymethyl)oxane-2,3,4,5-tetrol
    • MPP56UF5I7
    • SCHEMBL8068908
    • Inchi: 1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4-,5-,6+/m1/s1
    • InChI Key: LKDRXBCSQODPBY-KAZBKCHUSA-N
    • SMILES: O1C[C@H]([C@H]([C@H]([C@@]1(CO)O)O)O)O

Computed Properties

  • Exact Mass: 180.06338810g/mol
  • Monoisotopic Mass: 180.06338810g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 162
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -2.8
  • Topological Polar Surface Area: 110?2
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