Cas no 101383-42-0 (1,2-Propanedione,1-[(6R)-2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl]- (9CI))

1,2-Propanedione,1-[(6R)-2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl]- (9CI) structure
101383-42-0 structure
Product Name:1,2-Propanedione,1-[(6R)-2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl]- (9CI)
CAS No:101383-42-0
MF:C9H11N5O3
MW:237.215340852737
CID:140472
PubChem ID:135440065
Update Time:2025-04-19

1,2-Propanedione,1-[(6R)-2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl]- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 1,2-Propanedione,1-[(6R)-2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl]- (9CI)
    • 1-[(6R)-2-amino-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl]propane-1,2-dione
    • 1-[(6R)-2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pteridin-6-yl]propane-1,2- dione
    • 6(R)-Pyruvoyltetra-hydropterin
    • 1,2-Propanedione, 1-(2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)-(R)
    • 1,2-Propanedione, 1-[(6R)-2-amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl]-
    • 1,2-Propanedione, 1-[(6R)-2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl]
    • PPH4
    • 101383-42-0
    • 1-[(6R)-2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pteridin-6-yl]propane-1,2-dione
    • (6R)-6-pyruvoyl-5,6,7,8-tetrahydropterin
    • (6R)-6-pyruvoyl tetrahydropterin
    • V5W5D2642S
    • Q64221167
    • 6-Pyruvoyl tetrahydropteridine
    • 1,2-Propanedione, 1-((6R)-2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)
    • CHEBI:136564
    • 6-pyr-uvoyl-5,6,7,8-tetrahydropterin
    • DTXSID90906108
    • (R)-dyspropterin
    • 1-((6R)-2-Azanyl-4-oxidanyl-5,6,7,8-tetrahydropteridin-6-yl)propane-1,2-dione
    • UNII-V5W5D2642S
    • Pyruvoyl-H4-pterin
    • WBJZXBUVECZHCE-SCSAIBSYSA-N
    • 1-(4-Hydroxy-2-imino-1,2,5,6,7,8-hexahydropteridin-6-yl)propane-1,2-dione
    • 1-[(6R)-2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pteridin-6-yl]propane-1,2-dione
    • Inchi： 1S/C9H11N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h4,12H,2H2,1H3,(H4,10,11,13,14,17)/t4-/m1/s1
    • InChI Key： WBJZXBUVECZHCE-SCSAIBSYSA-N
    • SMILES： O=C(C(C)=O)[C@H]1CNC2=C(C(NC(N)=N2)=O)N1

Computed Properties

  • Exact Mass: 237.08633
  • Monoisotopic Mass: 237.086189
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 479
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.7
  • Topological Polar Surface Area: 126

Experimental Properties

  • Density: 1.86
  • Boiling Point: 449.4°C at 760 mmHg
  • Flash Point: 225.6°C
  • Refractive Index: 1.821
  • PSA: 125.68
  • LogP: -0.66540

1,2-Propanedione,1-[(6R)-2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl]- (9CI) Related Literature

101383-42-0 (1,2-Propanedione,1-[(6R)-2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl]- (9CI)) Related Products

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