Chem
J-GLOBAL ID:200907048640006644   Nikkaji number:J592.448K

2,4,6-Trimethylbenzoic acid Z-L-Phe-L-Ala-methyl ester

2,4,6-トリメチル安息香酸Z-L-Phe-L-Ala-メチル
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: C31H34N2O6
Molecular formula furigana: C31-H34-N2-O6
Molecular weight: 530.621
InChI: InChI=1S/C31H34N2O6/c1-20-15-21(2)28(22(3)16-20)30(36)38-19-27(34)23(4)32-29(35)26(17-24-11-7-5-8-12-24)33-31(37)39-18-25-13-9-6-10-14-25/h5-16,23,26H,17-19H2,1-4H3,(H,32,35)(H,33,37)/t23-,26-/m0/s1
InChI key: OFCOJPYLXMKAGH-OZXSUGGESA-N
SMILES: C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)COC(=O)c1c(C)cc(C)cc1C
Systematic name  (4):
  • 2,4,6-トリメチル安息香酸(Z-L-Phe-L-Ala-)メチル
  • 2,4,6-トリメチル安息香酸Z-L-Phe-L-Ala-メチル
  • (3S)-3-[(2S)-2-{[(ベンジルオキシ)カルボニル]アミノ}-3-フェニルプロパンアミド]-2-オキソブチル 2,4,6-トリメチルベンゾアート
  • (3S)-3-[(2S)-2-{[(benzyloxy)carbonyl]amino}-3-phenylpropanamido]-2-oxobutyl 2,4,6-trimethylbenzoate
Other name (2):
  • 2,4,6-Trimethylbenzoic acid (Z-L-Phe-L-Ala-)methyl ester
  • 2,4,6-Trimethylbenzoic acid Z-L-Phe-L-Ala-methyl ester
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