Cas no 3672-15-9 (D-Mannose,6-(dihydrogen phosphate))

D-Mannose,6-(dihydrogen phosphate) structure
3672-15-9 structure
Product Name:D-Mannose,6-(dihydrogen phosphate)
CAS No:3672-15-9
MF:C6H13O9P
MW:260.135783910751
CID:306898
PubChem ID:6101690
Update Time:2024-02-29

D-Mannose,6-(dihydrogen phosphate) Chemical and Physical Properties

Names and Identifiers

    • D-Mannose,6-(dihydrogen phosphate)
    • 6-O-Phosphono-β-D-mannopyranose
    • C00092
    • D-GLUCOSE 6-PHOSPHATE
    • D-glucose 6-phosphate free acid
    • D-Glucose 6-phosphate solution
    • D-Glucose 6-phosphoric acid
    • D-glucose-6-phosphate
    • G6P
    • glucose 6-(dihydrogen phosphate)
    • glucose-6-phosphate
    • ROBISON ESTER
    • [(2R,3R,4S,5S)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxyphosphonic acid
    • Mannose 6-phosphate
    • (3,4,5,6-tetrahydroxyoxan-2-yl)methoxyphosphonic acid
    • D-Mannose 6-phosphoric acid
    • D-Mannose-6-phosphate
    • M6P
    • D-mannopyranose 6-phosphate
    • D-Mannose, 6-(dihydrogen phosphate)
    • NS00069016
    • aldehydo-D-mannose 6-(dihydrogen phosphate)
    • U2S53JF879
    • Juvidex
    • (2R,3R,4S,5S)-2,3,4,5-Tetrahydroxy-6-oxohexyl dihydrogen phosphate
    • UNII-U2S53JF879
    • D-MANNOSE, 6-PHOSPHATE
    • A074F4FA-F19B-4AFA-AF19-0E6F967A7E91
    • aldehydo-D-mannose 6-phosphate
    • ((2R,3S,4S,5S)-3,4,5,6-TETRAHYDROXYTETRAHYDRO-2H-PYRAN-2-YL)METHYL DIHYDROGEN PHOSPHATE
    • 6-O-phosphono-D-mannose
    • CHEBI:48042
    • DB11848
    • DTXSID80957947
    • [(2R,3R,4S,5S)-2,3,4,5-tetrahydroxy-6-oxohexyl] dihydrogen phosphate
    • SCHEMBL54511
    • ALPHA-D-GLUCOSE-6-PHOSPHATE
    • 6-O-phosphonato-D-glucopyranose
    • Glc6P
    • 6-O-phosphono-D-glucopyranose
    • 6-O-phosphono-beta-D-glucopyranose
    • Glucose 6-phosphate
    • 6-O-phosphono-alpha-D-glucopyranose
    • beta-D-glucose 6-(dihydrogen phosphate)
    • alpha-D-Glucose 6-phosphate
    • 6-H2PO3Glcbeta
    • D-glucopyranose 6-phosphate
    • Beta-D-Glucose 6-phosphate
    • D-Mannose 6-phosphate
    • beta-D-Glucose 6-phosphic acid
    • D-glucopyranose 6-phosphate dianion
    • BETA-D-GLUCOSE-6-PHOSPHATE
    • Inchi： 1S/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H2,12,13,14)/t3-,4-,5-,6-/m1/s1
    • InChI Key： VFRROHXSMXFLSN-KVTDHHQDSA-N
    • SMILES： O=C[C@H]([C@H]([C@@H]([C@@H](COP(O)(O)=O)O)O)O)O

Computed Properties

  • Exact Mass: 260.03
  • Monoisotopic Mass: 260.03
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 277
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 157A^2
  • XLogP3: -4.5

Experimental Properties

  • Density: 1.97
  • Boiling Point: 564.1°Cat760mmHg
  • Flash Point: 295°C
  • Refractive Index: 1.637
  • PSA: 166.72000
  • LogP: -3.10440
  • pka: 1.84±0.10(Predicted)

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