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ID	http://purl.obolibrary.org/obo/CHEBI_44185 http://purl.obolibrary.org/obo/CHEBI_44185 https://agroportal.lirmm.fr/ontologies/EFO/CHEBI_44185 Loading
Preferred name	methotrexate
Synonyms	METHOTREXATE Methotrexate N-(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}benzoyl)-L-glutamic acid MTX 4-amino-10-methylfolic acid 4-amino-N(10)-methylpteroylglutamic acid Emtexate Ledertrexate Rheumatrex N-[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-L-glutamic acid Trexall methotrexate methotrexatum metotrexato See more See less

rdf:type	http://www.w3.org/2002/07/owl#Class Loading
rdfs:subClassOf	http://purl.obolibrary.org/obo/CHEBI_24532 Loading http://purl.obolibrary.org/obo/CHEBI_33575 Loading http://purl.obolibrary.org/obo/CHEBI_37622 Loading
rdfs:label	methotrexate
skos:notation	CHEBI:44185
oboinowl_gen:hasExactSynonym	METHOTREXATE Methotrexate N-(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}benzoyl)-L-glutamic acid
oboinowl_gen:hasDbXref	Beilstein:70669 CAS:59-05-2 DrugBank:DB00563 Drug_Central:1751 KEGG:C01937 KEGG:D00142 LINCS:LSM-5690 PDBeChem:MTX Patent:US2512572 Wikipedia:Methotrexate NCIt:C642 SNOMEDCT:387381009 SNOMEDCT:68887009 MESH:D008727 See more See less
oboinowl_gen:hasOBONamespace	chebi_ontology
oboinowl_gen:id	CHEBI:44185
oboinowl_gen:inSubset	http://purl.obolibrary.org/obo/chebi#3_STAR Loading
oboinowl_gen:hasRelatedSynonym	MTX 4-amino-10-methylfolic acid 4-amino-N(10)-methylpteroylglutamic acid Emtexate Ledertrexate Rheumatrex N-[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-L-glutamic acid Trexall methotrexate methotrexatum metotrexato See more See less
oboinowl_gen:hasAlternativeId	CHEBI:44183 CHEBI:6837
obo_purl:charge	0
obo_purl:formula	C20H22N8O5
obo_purl:inchi	InChI=1S/C20H22N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27)/t13-/m0/s1
obo_purl:inchikey	FBOZXECLQNJBKD-ZDUSSCGKSA-N
obo_purl:mass	454.43960
obo_purl:monoisotopicmass	454.17132
obo_purl:smiles	CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O

Subject	Author	Type	Created
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