Chem
J-GLOBAL ID:201207017989601100
Nikkaji number:J3.118.937C
L-Glu-L-Arg-4-Chloro-L-Phe-OH
L-Glu-L-Arg-4-クロロ-L-Phe-OH
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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:
C20 H29 ClN6 O6
Molecular formula furigana:
C20-H29-CL-N6-O6
Molecular weight:
484.940
InChI:
InChI=1S/C20H29ClN6O6/c21-12-5-3-11(4-6-12)10-15(19(32)33)27-18(31)14(2-1-9-25-20(23)24)26-17(30)13(22)7-8-16(28)29/h3-6,13-15H,1-2,7-10,22H2,(H,26,30)(H,27,31)(H,28,29)(H,32,33)(H4,23,24,25)/t13-,14-,15-/m0/s1
InChI key:
BEJDYIIEDPZERF-KKUMJFAQSA-N
SMILES:
N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)O
Systematic name (3):
L-Glu-L-Arg-4-クロロ-L-Phe-OH
(4S)-4-アミノ-4-{[(1S)-4-カルバムイミドアミド-1-{[(1S)-1-カルボキシ-2-(4-クロロフェニル)エチル]カルバモイル}ブチル]カルバモイル}ブタン酸
(4S)-4-amino-4-{[(1S)-4-carbamimidamido-1-{[(1S)-1-carboxy-2-(4-chlorophenyl)ethyl]carbamoyl}butyl]carbamoyl}butanoic acid
Other name (1):
L-Glu-L-Arg-4-Chloro-L-Phe-OH
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