Chem
J-GLOBAL ID：200907005787099850   Nikkaji number：J1.630.571E

(5S)-5α-(1-Carboxyethenyloxy)-6β-amino-1,3-cyclohexadiene-1-carboxylic acid

(5S)-5α-(1-カルボキシエテニルオキシ)-6β-アミノ-1,3-シクロヘキサジエン-1-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： C10H11NO5
Molecular formula furigana： C10-H11-N-O5
Molecular weight： 225.200
InChI： InChI=1S/C10H11NO5/c1-5(9(12)13)16-7-4-2-3-6(8(7)11)10(14)15/h2-4,7-8H,1,11H2,(H,12,13)(H,14,15)/t7-,8-/m0/s1
InChI key： OKLGKGPAZUNROU-YUMQZZPRSA-N
SMILES： N[C@@H]1[C@@H](OC(=C)C(=O)O)C=CC=C1C(=O)O
Systematic name  (3)：
  • (5S)-5α-(1-カルボキシエテニルオキシ)-6β-アミノ-1,3-シクロヘキサジエン-1-カルボン酸
  • (5S,6S)-6-アミノ-5-[(1-カルボキシエタ-1-エン-1-イル)オキシ]シクロヘキサ-1,3-ジエン-1-カルボン酸
  • (5S,6S)-6-amino-5-[(1-carboxyeth-1-en-1-yl)oxy]cyclohexa-1,3-diene-1-carboxylic acid
Other name (1)：
  • (5S)-5α-(1-Carboxyethenyloxy)-6β-amino-1,3-cyclohexadiene-1-carboxylic acid
KEGG COMPOUND： C18054
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