Chem
J-GLOBAL ID：200907095391582042   Nikkaji number：J1.022.405E

N-(2-Hydroxybenzoyl)-D-Val-L-Phe-D-Met-OH

N-(2-ヒドロキシベンゾイル)-D-Val-L-Phe-D-Met-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： C26H33N3O6S
Molecular formula furigana： C26-H33-N3-O6-S
Molecular weight： 515.630
InChI： InChI=1S/C26H33N3O6S/c1-16(2)22(29-23(31)18-11-7-8-12-21(18)30)25(33)28-20(15-17-9-5-4-6-10-17)24(32)27-19(26(34)35)13-14-36-3/h4-12,16,19-20,22,30H,13-15H2,1-3H3,(H,27,32)(H,28,33)(H,29,31)(H,34,35)/t19-,20+,22-/m1/s1
InChI key： JUXXRKYJJUHOML-RZUBCFFCSA-N
SMILES： CSCC[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](NC(=O)c1ccccc1O)C(C)C)C(=O)O
Systematic name  (3)：
  • N-(2-ヒドロキシベンゾイル)-D-Val-L-Phe-D-Met-OH
  • (2R)-2-[(2S)-2-[(2R)-2-[(2-ヒドロキシフェニル)ホルムアミド]-3-メチルブタンアミド]-3-フェニルプロパンアミド]-4-(メチルスルファニル)ブタン酸
  • (2R)-2-[(2S)-2-[(2R)-2-[(2-hydroxyphenyl)formamido]-3-methylbutanamido]-3-phenylpropanamido]-4-(methylsulfanyl)butanoic acid
Other name (1)：
  • N-(2-Hydroxybenzoyl)-D-Val-L-Phe-D-Met-OH
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