Chem
J-GLOBAL ID:200907050955850537   Nikkaji number:J1.333.052B

L-Lys-L-Ile-L-His-L-Pro-L-Phe-L-Ala-L-Gln-OH

L-Lys-L-Ile-L-His-L-Pro-L-Phe-L-Ala-L-Gln-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: C40H61N11O9
Molecular formula furigana: C40-H61-N11-O9
Molecular weight: 839.996
InChI: InChI=1S/C40H61N11O9/c1-4-23(2)33(50-35(54)27(42)13-8-9-17-41)38(57)49-30(20-26-21-44-22-45-26)39(58)51-18-10-14-31(51)37(56)48-29(19-25-11-6-5-7-12-25)36(55)46-24(3)34(53)47-28(40(59)60)15-16-32(43)52/h5-7,11-12,21-24,27-31,33H,4,8-10,13-20,41-42H2,1-3H3,(H2,43,52)(H,44,45)(H,46,55)(H,47,53)(H,48,56)(H,49,57)(H,50,54)(H,59,60)/t23-,24-,27-,28-,29-,30-,31-,33-/m0/s1
InChI key: VQXRAPDKSIVKIM-VWWINSOLSA-N
SMILES: CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)O
Systematic name  (3):
  • L-Lys-L-Ile-L-His-L-Pro-L-Phe-L-Ala-L-Gln-OH
  • (2S)-4-カルバモイル-2-[(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-[(2S,3S)-2-[(2S)-2,6-ジアミノヘキサンアミド]-3-メチルペンタンアミド]-3-(1H-イミダゾール-4-イル)プロパノイル]ピロリジン-2-イル]ホルムアミド}-3-フェニルプロパンアミド]プロパンアミド]ブタン酸
  • (2S)-4-carbamoyl-2-[(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-[(2S,3S)-2-[(2S)-2,6-diaminohexanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-phenylpropanamido]propanamido]butanoic acid
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