Chem
J-GLOBAL ID：200907069463351139   Nikkaji number：J122.458A

Methotrexate sodium

メトトレキサートナトリウム
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H21N8NaO5
Molecular formula furigana： C20-H21-N8-NA-O5
Molecular weight： 476.429
InChI： InChI=1S/C20H22N8O5.Na/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);/q;+1/p-1/t13-;/m0./s1
InChI key： BKBBTCORRZMASO-ZOWNYOTGSA-M
SMILES： CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O[Na]
Systematic name  (3)：
  • N-[4-[[(2,4-ジアミノプテリジン-6-イル)メチル]メチルアミノ]ベンゾイル]-L-グルタミン酸水素1-ナトリウム
  • (4S)-4-[(4-{[(2,4-ジアミノプテリジン-6-イル)メチル](メチル)アミノ}フェニル)ホルムアミド]-5-オキソ-5-(ソジオオキシ)ペンタン酸
  • (4S)-4-[(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}phenyl)formamido]-5-oxo-5-(sodiooxy)pentanoic acid
Other name (5)：
  • メトトレキサートナトリウム
  • MTXナトリウム
  • MTX sodium
  • Methotrexate sodium
  • N-[4-[[(2,4-Diaminopteridin-6-yl)methyl]methylamino]benzoyl]-L-glutamic acid hydrogen 1-sodium salt
Regulation number (1)：
  • MA1240000
Thsaurus map：
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