CAS: 133073-73-1 | Methotrexate hydrate, NX78453

SKU: NX78453-1G
CAS: 133073-73-1 | Methotrexate hydrate, NX78453

CAS: 133073-73-1 | Methotrexate hydrate, NX78453

SKU: NX78453-1G
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Product Identifiers

Catalog # NX78453
CAS Number 133073-73-1
PubChem CID 126941
Chemical Name Methotrexate hydrate
IUPAC Name (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid
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
InChIKey FBOZXECLQNJBKD-ZDUSSCGKSA-N
SMILES CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O
MDL Number MFCD00150847

Specification

MW 454.44 (anhydrous)
MF C20H22N8O5 á xH2O
Product Notes -20¡C
Cat Number GA6211
Manufacturer Glentham Life Sciences
Country of Origin United Kingdom

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