Chem
J-GLOBAL ID:200907000507535879   Nikkaji number:J2.386.715J

Nα-[3-(4-Biphenylyl)-N-(3,5-dimethylbenzoyl)-N-methyl-D-alanyl]-L-tryptophan

Nα-[3-(4-ビフェニリル)-N-(3,5-ジメチルベンゾイル)-N-メチル-D-アラニル]-L-トリプトファン
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: C36H35N3O4
Molecular formula furigana: C36-H35-N3-O4
Molecular weight: 573.693
InChI: InChI=1S/C36H35N3O4/c1-23-17-24(2)19-28(18-23)35(41)39(3)33(20-25-13-15-27(16-14-25)26-9-5-4-6-10-26)34(40)38-32(36(42)43)21-29-22-37-31-12-8-7-11-30(29)31/h4-19,22,32-33,37H,20-21H2,1-3H3,(H,38,40)(H,42,43)/t32-,33+/m0/s1
InChI key: UZDORQWMYRRLQV-JHOUSYSJSA-N
SMILES: CN([C@H](Cc1ccc(cc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)c1cc(C)cc(C)c1
Systematic name  (3):
  • Nα-[3-(4-ビフェニリル)-N-(3,5-ジメチルベンゾイル)-N-メチル-D-アラニル]-L-トリプトファン
  • (2S)-2-[(2R)-3-{[1,1'-ビフェニル]-4-イル}-2-[1-(3,5-ジメチルフェニル)-N-メチルホルムアミド]プロパンアミド]-3-(1H-インドール-3-イル)プロパン酸
  • (2S)-2-[(2R)-3-{[1,1'-biphenyl]-4-yl}-2-[1-(3,5-dimethylphenyl)-N-methylformamido]propanamido]-3-(1H-indol-3-yl)propanoic acid
Other name (1):
  • Nα-[3-(4-Biphenylyl)-N-(3,5-dimethylbenzoyl)-N-methyl-D-alanyl]-L-tryptophan
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