Chem
J-GLOBAL ID：200907048675476481   Nikkaji number：J1.801.726A

(1R)-1β,4β,5α-Trihydroxy-3-fluoro-2-cyclohexene-1-carboxylic acid

(1R)-1β,4β,5α-トリヒドロキシ-3-フルオロ-2-シクロヘキセン-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： C7H9FO5
Molecular formula furigana： C7-H9-F-O5
Molecular weight： 192.142
InChI： InChI=1S/C7H9FO5/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h1,4-5,9-10,13H,2H2,(H,11,12)/t4-,5-,7+/m1/s1
InChI key： DGZQZSSRYAJDAX-XAHCXIQSSA-N
SMILES： O[C@@H]1C[C@@](O)(C=C(F)[C@H]1O)C(=O)O
Systematic name  (4)：
  • (1R,4S,5R)-1,4,5-トリヒドロキシ-3-フルオロ-2-シクロヘキセン-1-カルボン酸
  • (1R)-1β,4β,5α-トリヒドロキシ-3-フルオロ-2-シクロヘキセン-1-カルボン酸
  • (1R,4S,5R)-3-フルオロ-1,4,5-トリヒドロキシシクロヘキサ-2-エン-1-カルボン酸
  • (1R,4S,5R)-3-fluoro-1,4,5-trihydroxycyclohex-2-ene-1-carboxylic acid
Other name (2)：
  • (1R,4S,5R)-1,4,5-Trihydroxy-3-fluoro-2-cyclohexene-1-carboxylic acid
  • (1R)-1β,4β,5α-Trihydroxy-3-fluoro-2-cyclohexene-1-carboxylic acid
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