Chem
J-GLOBAL ID：200907029097164000   Nikkaji number：J276.676K

N-(L-α-Aspartyl)-D-phenylglycine 1-[(1S)-2,2,4-trimethylbicyclo[2.2.1]heptan-3α-yl] ester

N-(L-α-アスパルチル)-D-フェニルグリシン1-[(1S)-2,2,4-トリメチルビシクロ[2.2.1]ヘプタン-3α-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： C22H30N2O5
Molecular formula furigana： C22-H30-N2-O5
Molecular weight： 402.491
InChI： InChI=1S/C22H30N2O5/c1-21(2)14-9-10-22(3,12-14)20(21)29-19(28)17(13-7-5-4-6-8-13)24-18(27)15(23)11-16(25)26/h4-8,14-15,17,20H,9-12,23H2,1-3H3,(H,24,27)(H,25,26)/t14-,15-,17+,20-,22?/m0/s1
InChI key： JTPQCIDNMXVPHL-MXNHHVGHSA-N
SMILES： CC12CC[C@@H](C1)C(C)(C)[C@@H]2OC(=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)-2,2,4-トリメチルビシクロ[2.2.1]ヘプタン-3α-イル]
  • (3S)-3-アミノ-3-{[(1R)-2-オキソ-1-フェニル-2-{[(2R,4S)-1,3,3-トリメチルビシクロ[2.2.1]ヘプタン-2-イル]オキシ}エチル]カルバモイル}プロパン酸
  • (3S)-3-amino-3-{[(1R)-2-oxo-1-phenyl-2-{[(2R,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-yl]oxy}ethyl]carbamoyl}propanoic acid
Other name (1)：
  • N-(L-α-Aspartyl)-D-phenylglycine 1-[(1S)-2,2,4-trimethylbicyclo[2.2.1]heptan-3α-yl] ester
Thsaurus map：
Thesaurus Map

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