basic_info |
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| Product_Name： | METHOTREXATE DIMETHYL ESTER |
| CAS： | 34378-65-9 |
| EnglishSynonyms： | METHOTREXATE DIMETHYL ESTER ; N-[4-[[(2,4-DIAMINO-6-PTERIDINYL)METHYL]METHYLAMINO]BENZOYL]-L-GLUTAMIC ACID DIMETHYL ESTER ; DIMETHYL METHOTREXATE |
| pro_mdlNumber： | MFCD09840873 |
| pro_acceptors： | 13 |
| pro_donors： | 3 |
| pro_smile： | CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)OC)C(=O)OC |
| InChi： | InChI=1S/C22H26N8O5/c1-30(11-13-10-25-19-17(26-13)18(23)28-22(24)29-19)14-6-4-12(5-7-14)20(32)27-15(21(33)35-3)8-9-16(31)34-2/h4-7,10,15H,8-9,11H2,1-3H3,(H,27,32)(H4,23,24,25,28,29)/t15-/m0/s1 |
| InChiKey： | InChIKey=DIQFVFAFHNQUTG-HNNXBMFYSA-N |
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