Chem
J-GLOBAL ID：200907062548213776   Nikkaji number：J2.224.914B

N-Methyl-L-Thr-[(βS)-β-methoxy-D-Tyr-]-L-Hpr-OH

N-メチル-L-Thr-[(βS)-β-メトキシ-D-Tyr-]-L-Hpr-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： C21H31N3O7
Molecular formula furigana： C21-H31-N3-O7
Molecular weight： 437.493
InChI： InChI=1S/C21H31N3O7/c1-12(25)16(22-2)19(27)23-17(18(31-3)13-7-9-14(26)10-8-13)20(28)24-11-5-4-6-15(24)21(29)30/h7-10,12,15-18,22,25-26H,4-6,11H2,1-3H3,(H,23,27)(H,29,30)/t12-,15+,16+,17-,18+/m1/s1
InChI key： FNTQBXSPXKEPCK-FMUWMXLXSA-N
SMILES： CN[C@@H]([C@@H](C)O)C(=O)N[C@H]([C@@H](OC)c1ccc(O)cc1)C(=O)N1CCCC[C@H]1C(=O)O
Systematic name  (3)：
  • N-メチル-L-Thr-[(βS)-β-メトキシ-D-Tyr-]-L-Hpr-OH
  • (2S)-1-[(2R,3S)-2-[(2S,3R)-3-ヒドロキシ-2-(メチルアミノ)ブタンアミド]-3-(4-ヒドロキシフェニル)-3-メトキシプロパノイル]ピペリジン-2-カルボン酸
  • (2S)-1-[(2R,3S)-2-[(2S,3R)-3-hydroxy-2-(methylamino)butanamido]-3-(4-hydroxyphenyl)-3-methoxypropanoyl]piperidine-2-carboxylic acid
Other name (1)：
  • N-Methyl-L-Thr-[(βS)-β-methoxy-D-Tyr-]-L-Hpr-OH
Thsaurus map：
Thesaurus Map

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