Chem
J-GLOBAL ID:200907073311150160   Nikkaji number:J1.472.629B

Pro-Glu-Phe-Glu-Phe-Glu-Phe-Glu-Phe-Glu-Phe-Glu-Phe-Glu-Phe-Glu-Pro-OH

Pro-Glu-Phe-Glu-Phe-Glu-Phe-Glu-Phe-Glu-Phe-Glu-Phe-Glu-Phe-Glu-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: C113H135N17O34
Molecular formula furigana: C113-H135-N17-O34
Molecular weight: 2275.408
InChI: InChI=1S/C113H135N17O34/c131-89(132)48-40-73(115-97(147)72-38-22-56-114-72)98(148)123-81(58-65-24-8-1-9-25-65)105(155)116-74(41-49-90(133)134)99(149)124-82(59-66-26-10-2-11-27-66)106(156)117-75(42-50-91(135)136)100(150)125-83(60-67-28-12-3-13-29-67)107(157)118-76(43-51-92(137)138)101(151)126-84(61-68-30-14-4-15-31-68)108(158)119-77(44-52-93(139)140)102(152)127-85(62-69-32-16-5-17-33-69)109(159)120-78(45-53-94(141)142)103(153)128-86(63-70-34-18-6-19-35-70)110(160)121-79(46-54-95(143)144)104(154)129-87(64-71-36-20-7-21-37-71)111(161)122-80(47-55-96(145)146)112(162)130-57-23-39-88(130)113(163)164/h1-21,24-37,72-88,114H,22-23,38-64H2,(H,115,147)(H,116,155)(H,117,156)(H,118,157)(H,119,158)(H,120,159)(H,121,160)(H,122,161)(H,123,148)(H,124,149)(H,125,150)(H,126,151)(H,127,152)(H,128,153)(H,129,154)(H,131,132)(H,133,134)(H,135,136)(H,137,138)(H,139,140)(H,141,142)(H,143,144)(H,145,146)(H,163,164)/t72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-/m0/s1
InChI key: SWQRYCJHLLAAHG-OBQOEHBUSA-N
SMILES: OC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)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)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)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-Phe-Glu-Phe-Glu-Phe-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)-2-[(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)-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)-2-[(2S)-4-carboxy-2-[(2S)-2-[(2S)-4-carboxy-2-[(2S)-2-[(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]butanamido]-3-phenylpropanamido]butanamido]-3-phenylpropanamido]butanamido]-3-phenylpropanamido]butanamido]-3-phenylpropanamido]butanamido]-3-phenylpropanamido]butanoyl]pyrrolidine-2-carboxylic acid
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