Chem
J-GLOBAL ID:200907076138370999   Nikkaji number:J932.096B

N-[[[(4S)-1-Methyl-2,6-dioxohexahydropyrimidin]-4α-yl]carbonyl]-L-His-L-Pro-OH

N-[[[(4S)-1-メチル-2,6-ジオキソヘキサヒドロピリミジン]-4α-イル]カルボニル]-L-His-L-Pro-OH
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: C17H22N6O6
Molecular formula furigana: C17-H22-N6-O6
Molecular weight: 406.399
InChI: InChI=1S/C17H22N6O6/c1-22-13(24)6-10(21-17(22)29)14(25)20-11(5-9-7-18-8-19-9)15(26)23-4-2-3-12(23)16(27)28/h7-8,10-12H,2-6H2,1H3,(H,18,19)(H,20,25)(H,21,29)(H,27,28)/t10-,11-,12-/m0/s1
InChI key: ZJLMUEVCSWSNNQ-SRVKXCTJSA-N
SMILES: CN1C(=O)C[C@H](NC1=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)O
Systematic name  (3):
  • N-[[[(4S)-1-メチル-2,6-ジオキソヘキサヒドロピリミジン]-4α-イル]カルボニル]-L-His-L-Pro-OH
  • (2S)-1-[(2S)-3-(1H-イミダゾール-4-イル)-2-{[(4S)-1-メチル-2,6-ジオキソ-1,3-ジアジナン-4-イル]ホルムアミド}プロパノイル]ピロリジン-2-カルボン酸
  • (2S)-1-[(2S)-3-(1H-imidazol-4-yl)-2-{[(4S)-1-methyl-2,6-dioxo-1,3-diazinan-4-yl]formamido}propanoyl]pyrrolidine-2-carboxylic acid
Other name (1):
  • N-[[[(4S)-1-Methyl-2,6-dioxohexahydropyrimidin]-4α-yl]carbonyl]-L-His-L-Pro-OH
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