Chem
J-GLOBAL ID：200907044740633853
Nikkaji number：J1.472.626H
Pro-Glu-Phe-Glu-Phe-Glu-Pro-OH
Pro-Glu-Phe-Glu-Phe-Glu-Pro-OH
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： C43H55N7O14
Molecular formula furigana： C43-H55-N7-O14
Molecular weight： 893.948
InChI：
InChI=1S/C43H55N7O14/c51-34(52)18-15-28(45-37(57)27-13-7-21-44-27)38(58)48-31(23-25-9-3-1-4-10-25)40(60)46-29(16-19-35(53)54)39(59)49-32(24-26-11-5-2-6-12-26)41(61)47-30(17-20-36(55)56)42(62)50-22-8-14-33(50)43(63)64/h1-6,9-12,27-33,44H,7-8,13-24H2,(H,45,57)(H,46,60)(H,47,61)(H,48,58)(H,49,59)(H,51,52)(H,53,54)(H,55,56)(H,63,64)/t27-,28-,29-,30-,31-,32-,33-/m0/s1
InChI key：
MLOAMPNDLWRTPW-MRNVWEPHSA-N
SMILES：
OC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O
Systematic name (3)：
- Pro-Glu-Phe-Glu-Phe-Glu-Pro-OH
- (2S)-1-[(2S)-4-カルボキシ-2-[(2S)-2-[(2S)-4-カルボキシ-2-[(2S)-2-[(2S)-4-カルボキシ-2-{[(2S)-ピロリジン-2-イル]ホルムアミド}ブタンアミド]-3-フェニルプロパンアミド]ブタンアミド]-3-フェニルプロパンアミド]ブタノイル]ピロリジン-2-カルボン酸
- (2S)-1-[(2S)-4-carboxy-2-[(2S)-2-[(2S)-4-carboxy-2-[(2S)-2-[(2S)-4-carboxy-2-{[(2S)-pyrrolidin-2-yl]formamido}butanamido]-3-phenylpropanamido]butanamido]-3-phenylpropanamido]butanoyl]pyrrolidine-2-carboxylic acid
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