Chem
J-GLOBAL ID：200907095591484665   Nikkaji number：J2.137.364H

Ala-Val-Val-Tyr-Gly-Leu-Arg-OH

Ala-Val-Val-Tyr-Gly-Leu-Arg-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： C36H60N10O9
Molecular formula furigana： C36-H60-N10-O9
Molecular weight： 776.937
InChI： InChI=1S/C36H60N10O9/c1-18(2)15-25(32(51)43-24(35(54)55)9-8-14-40-36(38)39)42-27(48)17-41-31(50)26(16-22-10-12-23(47)13-11-22)44-33(52)28(19(3)4)46-34(53)29(20(5)6)45-30(49)21(7)37/h10-13,18-21,24-26,28-29,47H,8-9,14-17,37H2,1-7H3,(H,41,50)(H,42,48)(H,43,51)(H,44,52)(H,45,49)(H,46,53)(H,54,55)(H4,38,39,40)/t21-,24-,25-,26-,28-,29-/m0/s1
InChI key： LGBYIYUPZYDJSO-JIPGPKKKSA-N
SMILES： CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O
Systematic name  (3)：
  • Ala-Val-Val-Tyr-Gly-Leu-Arg-OH
  • (2S)-2-[(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-アミノプロパンアミド]-3-メチルブタンアミド]-3-メチルブタンアミド]-3-(4-ヒドロキシフェニル)プロパンアミド]アセトアミド}-4-メチルペンタンアミド]-5-カルバムイミドアミドペンタン酸
  • (2S)-2-[(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-methylbutanamido]-3-methylbutanamido]-3-(4-hydroxyphenyl)propanamido]acetamido}-4-methylpentanamido]-5-carbamimidamidopentanoic acid
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