Chem
J-GLOBAL ID:200907005892403092   Nikkaji number:J276.673F

N-(L-α-Aspartyl)-D-phenylglycine 1-[(1S)-2-methylbicyclo[2.2.1]heptan-2α-yl] ester

N-(L-α-アスパルチル)-D-フェニルグリシン1-[(1S)-2-メチルビシクロ[2.2.1]ヘプタン-2α-イル]
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: C20H26N2O5
Molecular formula furigana: C20-H26-N2-O5
Molecular weight: 374.437
InChI: InChI=1S/C20H26N2O5/c1-20(11-12-7-8-14(20)9-12)27-19(26)17(13-5-3-2-4-6-13)22-18(25)15(21)10-16(23)24/h2-6,12,14-15,17H,7-11,21H2,1H3,(H,22,25)(H,23,24)/t12?,14-,15-,17+,20+/m0/s1
InChI key: DQXJLKHYJIKGGW-RWOZGTRNSA-N
SMILES: C[C@]1(CC2CC[C@H]1C2)OC(=O)[C@H](NC(=O)[C@@H](N)CC(=O)O)c1ccccc1
Systematic name  (3):
  • N-(L-α-アスパルチル)-D-フェニルグリシン1-[(1S)-2-メチルビシクロ[2.2.1]ヘプタン-2α-イル]
  • (3S)-3-アミノ-3-{[(1R)-2-{[(1S,2R)-2-メチルビシクロ[2.2.1]ヘプタン-2-イル]オキシ}-2-オキソ-1-フェニルエチル]カルバモイル}プロパン酸
  • (3S)-3-amino-3-{[(1R)-2-{[(1S,2R)-2-methylbicyclo[2.2.1]heptan-2-yl]oxy}-2-oxo-1-phenylethyl]carbamoyl}propanoic acid
Other name (1):
  • N-(L-α-Aspartyl)-D-phenylglycine 1-[(1S)-2-methylbicyclo[2.2.1]heptan-2α-yl] ester
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