| Compound-ID | 87 |
| Common Name | Methotrexate |
| Synonyms |
Rheumatrex
2,4-Diamino-N10-methylpteroyl glutamate MTX |
| 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
|
| SMILES |
CN(Cc1cnc2nc(N)nc(N)c2(n1))c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O
|
| External Links | |
| KEGG-COMPOUND-ID |
C01937
|
| PUBCHEM-ID | 5042 |
| ChEBI-ID |
44185
6837 50681 50680 44183 |
| METACYC-ID | CPD-6041 |
| METANETX-ID | MNXM729876 |
|
View all entries for compound: Methotrexate |