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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
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
Molecular formula： C20H22N8O5
Molecular formula furigana： C20-H22-N8-O5
Molecular weight： 454.447
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
InChI key：
FBOZXECLQNJBKD-ZDUSSCGKSA-N
SMILES：
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O
Systematic name (17)： - (S)-2-[[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]アミノ]ペンタン二酸
- N-[4-[メチル[(2,4-ジアミノプテリジン-6-イル)メチル]アミノ]ベンゾイル]グルタミン酸
- N-[4-[メチル(2,4-ジアミノプテリジン-6-イルメチル)アミノ]ベンゾイル]グルタミン酸
- 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
- N-[p-[[(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
Show all
- アメトプテリン
- エムテキサート
- A-メトプテリン
- メトトレキサート
- メトトレキセート
Show all
Regulation number (4)：
- 8-(2)-824
- 8-(2)-937
- EINECS2004138
- TSCA(59-05-2)
KEGG DRUG： D00142
KEGG COMPOUND： C01937
Application (4)：
antirheumatic drug
, antineoplastic antimetabolite
, insect chemosterilant
, immunosuppressant
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