Chem
J-GLOBAL ID：201407094673106166   Nikkaji number：J3.310.840K

(3aα)-Hexahydro-2α-vinyl-4-oxo-5-(2-hydroxyethyl)-6aα-(carboxymethyl)-2H-furo[2,3-c]pyrrole-6α-carboxylic acid

(3aα)-ヘキサヒドロ-2α-ビニル-4-オキソ-5-(2-ヒドロキシエチル)-6aα-(カルボキシメチル)-2H-フロ[2,3-c]ピロール-6α-カルボン酸
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： C13H17NO7
Molecular formula furigana： C13-H17-N-O7
Molecular weight： 299.279
InChI： InChI=1S/C13H17NO7/c1-2-7-5-8-11(18)14(3-4-15)10(12(19)20)13(8,21-7)6-9(16)17/h2,7-8,10,15H,1,3-6H2,(H,16,17)(H,19,20)/t7-,8+,10-,13+/m1/s1
InChI key： PQFQUJMJKZKVDY-HUZBHQLSSA-N
SMILES： OCCN1[C@H](C(=O)O)[C@@]2(CC(=O)O)O[C@@H](C[C@H]2C1=O)C=C
Systematic name  (3)：
  • (3aα)-ヘキサヒドロ-2α-ビニル-4-オキソ-5-(2-ヒドロキシエチル)-6aα-(カルボキシメチル)-2H-フロ[2,3-c]ピロール-6α-カルボン酸
  • (2S,3aR,6S,6aS)-6a-(カルボキシメチル)-2-エテニル-5-(2-ヒドロキシエチル)-4-オキソ-ヘキサヒドロ-2H-フロ[2,3-c]ピロール-6-カルボン酸
  • (2S,3aR,6S,6aS)-6a-(carboxymethyl)-2-ethenyl-5-(2-hydroxyethyl)-4-oxo-hexahydro-2H-furo[2,3-c]pyrrole-6-carboxylic acid
Other name (1)：
  • (3aα)-Hexahydro-2α-vinyl-4-oxo-5-(2-hydroxyethyl)-6aα-(carboxymethyl)-2H-furo[2,3-c]pyrrole-6α-carboxylic acid
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