Chemical Component Summary

Name5'-DEOXY-5'-METHYLTHIOADENOSINE
Identifiers(2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(methylsulfanylmethyl)oxolane-3,4-diol
FormulaC11 H15 N5 O3 S
Molecular Weight297.334
TypeNON-POLYMER
Isomeric SMILESCSC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)O
InChIInChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1
InChIKeyWUUGFSXJNOTRMR-IOSLPCCCSA-N

Chemical Details

Formal Charge0
Atom Count35
Chiral Atom Count4
Bond Count37
Aromatic Bond Count10

Drug Info: DrugBank

DrugBank IDDB02282 
Name5'-S-methyl-5'-thioadenosine
Groups experimental
Synonyms
  • Vitamin L2
  • 5'-Deoxy-5'-(methylthio)adenosine
  • MTA
  • 9-(5-S-methyl-5-thio-β-D-ribofuranosyl)-9H-purin-6-amine
  • Methylthioadenosine
Categories
  • Amino Acids
  • Amino Acids, Acidic
  • Amino Acids, Dicarboxylic
  • Amino Acids, Peptides, and Proteins
  • Anti-Infective Agents
CAS number2457-80-9

Drug Targets

NameTarget SequencePharmacological ActionActions
Modification methylase RsrIMANRSHHNAGHRAMNALRKSGQKHSSESQLGSSEIGTTRHVYDVCDCLDT...unknown
S-methyl-5'-thioadenosine phosphorylaseMASGTTTTAVKIGIIGGTGLDDPEILEGRTEKYVDTPFGKPSDALILGKI...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 439176
ChEMBL CHEMBL277041
ChEBI CHEBI:17509
CCDC/CSD TMSADS10