Chem
J-GLOBAL ID：200907079418575765
Nikkaji number：J762.508A
2-[Nα-[1-(N-Methyl-D-phenylalanyl)-L-prolyl]-L-arginyl]-1-methyl-1H-imidazole
2-[Nα-[1-(N-メチル-D-フェニルアラニル)-L-プロリル]-L-アルギニル]-1-メチル-1H-イミダゾール
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： C25H36N8O3
Molecular formula furigana： C25-H36-N8-O3
Molecular weight： 496.616
InChI：
InChI=1S/C25H36N8O3/c1-28-19(16-17-8-4-3-5-9-17)24(36)33-14-7-11-20(33)23(35)31-18(10-6-12-30-25(26)27)21(34)22-29-13-15-32(22)2/h3-5,8-9,13,15,18-20,28H,6-7,10-12,14,16H2,1-2H3,(H,31,35)(H4,26,27,30)/t18-,19+,20-/m0/s1
InChI key：
AZDLSQYZJKUEPP-ZCNNSNEGSA-N
SMILES：
CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)c1nccn1C
Systematic name (3)：
- 2-[Nα-[1-(N-メチル-D-フェニルアラニル)-L-プロリル]-L-アルギニル]-1-メチル-1H-イミダゾール
- (2S)-N-[(2S)-5-カルバムイミドアミド-1-(1-メチル-1H-イミダゾール-2-イル)-1-オキソペンタン-2-イル]-1-[(2R)-2-(メチルアミノ)-3-フェニルプロパノイル]ピロリジン-2-カルボキサミド
- (2S)-N-[(2S)-5-carbamimidamido-1-(1-methyl-1H-imidazol-2-yl)-1-oxopentan-2-yl]-1-[(2R)-2-(methylamino)-3-phenylpropanoyl]pyrrolidine-2-carboxamide
- 2-[Nα-[1-(N-Methyl-D-phenylalanyl)-L-prolyl]-L-arginyl]-1-methyl-1H-imidazole
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