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Substance Name: 10-Formyltetrahydropteroyl-gamma-glutamylglutamic acid
RN: 29552-62-3
InChIKey: BHBZPCBOCZGPTF-FMYDAXTQSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H30-N8-O9.5H2-O

Molecular Weight

  • 602.558
 
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Names and Synonyms

Name of Substance

  • 10-Formyltetrahydropteroyl-gamma-glutamylglutamic acid

Synonyms

  • 7-Hydro-8-methylpteroylglutamylglutamic acid pentahydrate
  • HMPGG

Systematic Names

  • L-Glutamic acid, N-(N-(4-(((2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl)formylamino)benzoyl)-L-gamma-glutamyl)-
  • L-Glutamic acid, N-(N-(4-(((2-amino-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl)formylamino)benzoyl)-L-gamma-glutamyl)-, hydrate (1:5)

Registry Numbers

CAS Registry Number

  • 29552-62-3

System Generated Number

  • 0029552623

Molecular Formulas

Molecular Formula

  • C25-H30-N8-O9.5H2-O

Molecular Formula Fragments

  • C25-H30-N8-O9
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C25H30N8O10/c26-25-31-20-19(22(39)32-25)28-13(9-27-20)10-33(11-34)14-3-1-12(2-4-14)21(38)30-16(24(42)43)5-7-17(35)29-15(23(40)41)6-8-18(36)37/h1-4,11,13,15-16,28H,5-10H2,(H,29,35)(H,30,38)(H,36,37)(H,40,41)(H,42,43)(H4,26,27,31,32,39)/t13?,15-,16-/m0/s1

InChIKey

BHBZPCBOCZGPTF-FMYDAXTQSA-N

Smiles

c1cc(ccc1C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)N(CC2CNc3c(c(=O)nc([nH]3)N)N2)C=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 200mg/kg (200mg/kg)   Journal of Antibiotics. Vol. 40, Pg. 251, 1987.