THG

(6S)-5,6,7,8-TETRAHYDROFOLATE


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Chemical Component Summary

Name(6S)-5,6,7,8-TETRAHYDROFOLATE
Identifiers(2S)-2-[[4-[[(6S)-2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pteridin-6-yl]methylamino]phenyl]carbonylamino]pentanedioic acid
FormulaC19 H23 N7 O6
Molecular Weight445.429
TypeNON-POLYMER
Isomeric SMILESc1cc(ccc1C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC[C@H]2CNC3=C(N2)C(=O)NC(=N3)N
InChIInChI=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)/t11-,12-/m0/s1
InChIKeyMSTNYGQPCMXVAQ-RYUDHWBXSA-N

Chemical Details

Formal Charge0
Atom Count55
Chiral Atom Count2
Bond Count57
Aromatic Bond Count12

Drug Info: DrugBank

DrugBank IDDB02031 
Name(6S)-5,6,7,8-tetrahydrofolic acid
Groups experimental
Synonyms
  • (6S)-5,6,7,8-tetrahydrofolic acid
  • (6S)-5,6,7,8-tetrahydropteroylglutamate
  • (6S)-H4folate
  • (6S)-5,6,7,8-tetrahydrofolate
  • (6S)-Tetrahydrofolic acid
Categories
  • Folic Acid and Derivatives
  • Vitamin B Complex
  • Vitamins
CAS number135-16-0

Drug Targets

NameTarget SequencePharmacological ActionActions
Nitric oxide synthase oxygenaseMEEKEILWNEAKAFIAACYQELGKEEEVKDRLADIKSEIDLTGSYVHTKE...unknown
Thymidylate synthaseMKQYLELMQKVLDEGTQKNDRTGTGTLSIFGHQMRFNLQDGFPLVTTKRC...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 5460413, 5289465, 135398650
ChEBI CHEBI:15635