Chem
J-GLOBAL ID：200907098890618740   Nikkaji number：J2.200.361E

2-[(4S)-3-Oxo-4-(tert-butyloxycarbonylamino)-5-phenylpentyl]-2,3-butadieneoic acid ethyl ester

エチル (6S)-6-{[(tert-ブトキシ)カルボニル]アミノ}-2-エテニリデン-5-オキソ-7-フェニルヘプタノアート
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： C22H29NO5
Molecular formula furigana： C22-H29-N-O5
Molecular weight： 387.476
InChI： InChI=1S/C22H29NO5/c1-6-17(20(25)27-7-2)13-14-19(24)18(15-16-11-9-8-10-12-16)23-21(26)28-22(3,4)5/h8-12,18H,1,7,13-15H2,2-5H3,(H,23,26)/t18-/m0/s1
InChI key： PXJUZDHCESBWGE-SFHVURJKSA-N
SMILES： CCOC(=O)C(=C=C)CCC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C
Systematic name  (3)：
  • 2-[(4S)-3-オキソ-4-(tert-ブチルオキシカルボニルアミノ)-5-フェニルペンチル]-2,3-ブタジエン酸エチル
  • エチル (6S)-6-{[(tert-ブトキシ)カルボニル]アミノ}-2-エテニリデン-5-オキソ-7-フェニルヘプタノアート
  • ethyl (6S)-6-{[(tert-butoxy)carbonyl]amino}-2-ethenylidene-5-oxo-7-phenylheptanoate
Other name (1)：
  • 2-[(4S)-3-Oxo-4-(tert-butyloxycarbonylamino)-5-phenylpentyl]-2,3-butadieneoic acid ethyl ester
Thsaurus map：
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