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raltitrexed

CHEBI:CHEBI_5847

Chemical Information

Molecular Formula
C21H22N4O6S
Molecular Mass
458.489
Charge
0
SMILES
CN(Cc1ccc2nc(C)[nH]c(=O)c2c1)c1ccc(s1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
InChI
InChI=1S/C21H22N4O6S/c1-11-22-14-4-3-12(9-13(14)19(28)23-11)10-25(2)17-7-6-16(32-17)20(29)24-15(21(30)31)5-8-18(26)27/h3-4,6-7,9,15H,5,8,10H2,1-2H3,(H,24,29)(H,26,27)(H,30,31)(H,22,23,28)/t15-/m0/s1
InChIKey
IVTVGDXNLFLDRM-HNNXBMFYSA-N

Alternative Names

  • D-1694
  • ICI D1694
  • ICI-D1694
  • Raltitrexed
  • Tomudex
  • ZD-1694
  • ZD1694

Treatment Applications

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

DRON_00010000
196239
oboInOwl#hasDbXref
PDBeChem:D16
core#notation
CHEBI:5847

Additional References

🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.

Additional Attributes

oboInOwl#hasOBONamespace
chebi_ontology
DRON_00010000
196239
oboInOwl#hasDbXref
PDBeChem:D16
oboInOwl#id
CHEBI:5847
core#notation
CHEBI:5847
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#2_STAR
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
rdf-schema#range
https://w3id.org/def/predibionto#has_drug_106541
has_treatment
http://purl.obolibrary.org/obo/DOID_219
owl#annotatedSource
t252516
owl#someValuesFrom
t554404