Chem
J-GLOBAL ID:200907087780684516   Nikkaji number:J762.509J

2-[Nα-[1-(N-Methyl-D-phenylalanyl)-L-prolyl]-L-arginyl]quinazolin-4(3H)-one

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]キナゾリン-4(3H)-オン
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: C29H36N8O4
Molecular formula furigana: C29-H36-N8-O4
Molecular weight: 560.659
InChI: InChI=1S/C29H36N8O4/c1-32-22(17-18-9-3-2-4-10-18)28(41)37-16-8-14-23(37)27(40)35-21(13-7-15-33-29(30)31)24(38)25-34-20-12-6-5-11-19(20)26(39)36-25/h2-6,9-12,21-23,32H,7-8,13-17H2,1H3,(H,35,40)(H4,30,31,33)(H,34,36,39)/t21-,22+,23-/m0/s1
InChI key: DSBAJYNIVIRLCB-ZRBLBEILSA-N
SMILES: CN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)c1nc2ccccc2c(=O)[nH]1
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]キナゾリン-4(3H)-オン
  • (2S)-N-[(2S)-5-カルバムイミドアミド-1-オキソ-1-(4-オキソ-3,4-ジヒドロキナゾリン-2-イル)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-oxo-1-(4-oxo-3,4-dihydroquinazolin-2-yl)pentan-2-yl]-1-[(2R)-2-(methylamino)-3-phenylpropanoyl]pyrrolidine-2-carboxamide
Other name (1):
  • 2-[Nα-[1-(N-Methyl-D-phenylalanyl)-L-prolyl]-L-arginyl]quinazolin-4(3H)-one
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