Chem
J-GLOBAL ID:200907004408958640   Nikkaji number:J525.299G

N-[3-[[(R)-3-(4-Amidinophenyl)-2-aminopropionyl]amino]benzoyl]-β-alanine

N-[3-[[(R)-3-(4-アミジノフェニル)-2-アミノプロピオニル]アミノ]ベンゾイル]-β-アラニン
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: C20H23N5O4
Molecular formula furigana: C20-H23-N5-O4
Molecular weight: 397.435
InChI: InChI=1S/C20H23N5O4/c21-16(10-12-4-6-13(7-5-12)18(22)23)20(29)25-15-3-1-2-14(11-15)19(28)24-9-8-17(26)27/h1-7,11,16H,8-10,21H2,(H3,22,23)(H,24,28)(H,25,29)(H,26,27)/t16-/m1/s1
InChI key: BBTXJCGFPCHCFR-MRXNPFEDSA-N
SMILES: N[C@H](Cc1ccc(cc1)C(=N)N)C(=O)Nc1cccc(c1)C(=O)NCCC(=O)O
Systematic name  (3):
  • N-[3-[[(R)-3-(4-アミジノフェニル)-2-アミノプロピオニル]アミノ]ベンゾイル]-β-アラニン
  • 3-({3-[(2R)-2-アミノ-3-(4-カルバムイミドイルフェニル)プロパンアミド]フェニル}ホルムアミド)プロパン酸
  • 3-({3-[(2R)-2-amino-3-(4-carbamimidoylphenyl)propanamido]phenyl}formamido)propanoic acid
Other name (1):
  • N-[3-[[(R)-3-(4-Amidinophenyl)-2-aminopropionyl]amino]benzoyl]-β-alanine
Thsaurus map:

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