Chem
J-GLOBAL ID:200907061125887880   Nikkaji number:J1.123.776B

[(2H5)Phe4]-methionine enkephalin

[(2H5)Phe4]メチオニンエンケファリン
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: C27H30[2H]5N5O7S
Molecular formula furigana: C27-H35-N5-O7-S
Molecular weight: 578.700
InChI: InChI=1S/C27H35N5O7S/c1-40-12-11-21(27(38)39)32-26(37)22(14-17-5-3-2-4-6-17)31-24(35)16-29-23(34)15-30-25(36)20(28)13-18-7-9-19(33)10-8-18/h2-10,20-22,33H,11-16,28H2,1H3,(H,29,34)(H,30,36)(H,31,35)(H,32,37)(H,38,39)/t20-,21-,22-/m0/s1/i2D,3D,4D,5D,6D
InChI key: YFGBQHOOROIVKG-TWCNNHQWSA-N
SMILES: c1([2H])c([2H])c([2H])c(C[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)N[C@@H](CCSC)C(=O)O)c([2H])c1[2H]
Systematic name  (3):
  • Tyr-Gly-Gly-(2,3,4,5,6-2H5)Phe-Met-OH
  • (2S)-2-[(2S)-2-(2-{2-[(2S)-2-アミノ-3-(4-ヒドロキシフェニル)プロパンアミド]アセトアミド}アセトアミド)-3-[(2,3,4,5,6-2H5)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
  • (2S)-2-[(2S)-2-(2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}acetamido)-3-[(2,3,4,5,6-2H5)phenyl]propanamido]-4-(methylsulfanyl)butanoic acid
Other name (2):
  • [(2H5)Phe4]メチオニンエンケファリン
  • [(2H5)Phe4]-methionine enkephalin
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