Cas no 29347-89-5 (Glutamic acid,N-[4-[[(2-amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-)

Glutamic acid,N-[4-[[(2-amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]- structure
29347-89-5 structure
Product Name:Glutamic acid,N-[4-[[(2-amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-
CAS No:29347-89-5
MF:C19H23N7O6
MW:445.429223299026
CID:263352
PubChem ID:135402046
Update Time:2025-04-19

Glutamic acid,N-[4-[[(2-amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]- Chemical and Physical Properties

Names and Identifiers

    • Glutamic acid,N-[4-[[(2-amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-
    • (6S,S)-5,6,7,8-tetrahydrofolic acid
    • DL-5,6,7,8-Tetrahydrofolic acid
    • DL-Glutamicacid, N-[4-[[(2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-
    • Glutamic acid,N-[4-[[(2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-(9CI)
    • Glutamic acid,N-[p-[[(2-amino-5,6,7,8-tetrahydro-4-hydroxy-6-pteridinyl)methyl]amino]benzoyl]-,DL- (8CI)
    • TETRAHYDROFOLICACID
    • glutamic acid, N-[4-[[(2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-
    • H4PteGlu
    • SCHEMBL8030
    • 2-[[4-[(2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
    • DL-Glutamic acid, N-(4-(((2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-
    • (6S)-tetrahydrofolate
    • Q168453
    • tetrahydropteroylglutamate
    • 2-[[4-[(2-amino-4-oxo-5, 6, 7, 8-tetrahydro-3H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
    • FT-0674997
    • DTXSID80951900
    • tetrahydropteroyl mono-L-glutamate
    • (6S)-5,6,7,8-tetrahydrofolate(2-)
    • 2-[[4-[(2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
    • 5,6,7,8-tetrahydrofolic acid
    • SB67355
    • N-(4-(((2-Amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl)amino)benzoyl)glutamic acid
    • 2-(4-(((2-Imino-4-oxo-1,2,3,4,5,6,7,8-octahydropteridin-6-yl)methyl)amino)benzamido)pentanedioic acid
    • 29347-89-5
    • 5,6,7,8-tetrahydrofolsaure
    • Inchi: 1S/C19H23N7O6/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28/h1-4,11-12,21,23H,5-8H2,(H,24,29)(H,27,28)(H,31,32)(H4,20,22,25,26,30)
    • InChI Key: MSTNYGQPCMXVAQ-UHFFFAOYSA-N
    • SMILES: O=C1C2=C(N=C(N)N1)NCC(CNC1C=CC(C(NC(C(=O)O)CCC(=O)O)=O)=CC=1)N2

Computed Properties

  • Exact Mass: 445.17119
  • Monoisotopic Mass: 445.171
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 9
  • Hydrogen Bond Acceptor Count: 13
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 10
  • Complexity: 834
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 207A^2
  • XLogP3: -0.6

Experimental Properties

  • Density: 1.7
  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 207.27

Glutamic acid,N-[4-[[(2-amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]- Related Literature

  • 1. Kinetics and mechanism of the autoxidation of the 2-amino-4-hydroxy-5,6,7,8-tetrahydropteridines
    John A. Blair,Anthony J. Pearson J. Chem. Soc. Perkin Trans. 2 1974 80
  • 2. Stereochemistry of reduction of the vitamin folic acid by dihydrofolate reductase
    Peter A. Charlton,Douglas W. Young,Berry Birdsall,James Feeney,Gordon C. K. Roberts J. Chem. Soc. Perkin Trans. 1 1985 1349
  • 3. Synthesis of a novel 5-deaza-5-thia analogue of tetrahydrofolic acid, N-(p-{[(2-amino-6,7-dihydro-4-oxo-3H,8H-pyrimido[5,4-b][1,4]thiazin-6-yl)methyl]amino}benzoyl)glutamic acid
    Reiko Totani,Magoichi Sako,Kosaku Hirota,Yoshifumi Maki J. Chem. Soc. Perkin Trans. 1 1994 833
  • 4. The preparation of the (6R)- and (6S)-diastereoisomers of 5-formyltetrahydrofolate (leucovorin)
    Jonathan Owens,Lilias Rees,Colin J. Suckling,Hamish C. S. Wood J. Chem. Soc. Perkin Trans. 1 1993 871
  • 5. Absolute configuration of 6-methyl-5,6,7,8-tetrahydropterin produced by enzymic reduction (dihydrofolate reductase and NADPH) of 6-methyl-7,8-dihydropterin
    Wilfred L. F. Armarego,Paul Waring,Jeffrey W. Williams J. Chem. Soc. Chem. Commun. 1980 334
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