Chem
J-GLOBAL ID：200907089337833501   Nikkaji number：J1.432.611A

N-[4-[2-[(2-Amino-4-methyl-7H-pyrrolo[2,3-d]pyrimidine)-5-yl]ethyl]benzoyl]-L-glutamic acid

N-[4-[2-[(2-アミノ-4-メチル-7H-ピロロ[2,3-d]ピリミジン)-5-イル]エチル]ベンゾイル]-L-グルタミン酸
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： C21H23N5O5
Molecular formula furigana： C21-H23-N5-O5
Molecular weight： 425.445
InChI： InChI=1S/C21H23N5O5/c1-11-17-14(10-23-18(17)26-21(22)24-11)7-4-12-2-5-13(6-3-12)19(29)25-15(20(30)31)8-9-16(27)28/h2-3,5-6,10,15H,4,7-9H2,1H3,(H,25,29)(H,27,28)(H,30,31)(H3,22,23,24,26)/t15-/m0/s1
InChI key： FICRNCFTTZHHPO-HNNXBMFYSA-N
SMILES： Cc1nc(N)nc2[nH]cc(CCc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)c12
Systematic name  (3)：
  • N-[4-[2-[(2-アミノ-4-メチル-7H-ピロロ[2,3-d]ピリミジン)-5-イル]エチル]ベンゾイル]-L-グルタミン酸
  • (2S)-2-{[4-(2-{2-アミノ-4-メチル-7H-ピロロ[2,3-d]ピリミジン-5-イル}エチル)フェニル]ホルムアミド}ペンタン二酸
  • (2S)-2-{[4-(2-{2-amino-4-methyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl}ethyl)phenyl]formamido}pentanedioic acid
Other name (1)：
  • N-[4-[2-[(2-Amino-4-methyl-7H-pyrrolo[2,3-d]pyrimidine)-5-yl]ethyl]benzoyl]-L-glutamic acid
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