Chem
J-GLOBAL ID:201007066772993848   Nikkaji number:J2.802.675G

5-Fluorocyclohexadiene-cis,cis-1,2-diol-1-carboxylate

5-フルオロシクロヘキサジエン-cis,cis-1,2-ジオール-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: C7H7FO4
Molecular formula furigana: C7-H7-F-O4
Molecular weight: 174.127
InChI: InChI=1S/C7H7FO4/c8-4-1-2-5(9)7(12,3-4)6(10)11/h1-3,5,9,12H,(H,10,11)/t5-,7+/m1/s1
InChI key: SFLUOXSDNSKORB-VDTYLAMSSA-N
SMILES: O[C@@H]1C=CC(=C[C@@]1(O)C(=O)O)F
Systematic name  (3):
  • (1S,2R)-5-フルオロ-1,2-ジヒドロキシ-3,5-シクロヘキサジエン-1-カルボン酸
  • (1S,6R)-3-フルオロ-1,6-ジヒドロキシシクロヘキサ-2,4-ジエン-1-カルボン酸
  • (1S,6R)-3-fluoro-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acid
Other name (3):
  • (1S,2R)-5-Fluoro-1,2-dihydroxy-3,5-cyclohexadiene-1-carboxylic acid
  • 5-Fluorocyclohexadiene-cis,cis-1,2-diol-1-carboxylate
  • 5-フルオロシクロヘキサジエン-cis,cis-1,2-ジオール-1-カルボン酸
KEGG COMPOUND: C16479
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