Chem
J-GLOBAL ID：201407005944207866   Nikkaji number：J3.297.516J

(3S,4R,5S)-3,4,5-Trihydroxycyclohexene-1-carboxylic acid ethyl ester

(3S,4R,5S)-3,4,5-トリヒドロキシシクロヘキセン-1-カルボン酸エチル
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： C9H14O5
Molecular formula furigana： C9-H14-O5
Molecular weight： 202.206
InChI： InChI=1S/C9H14O5/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3,6-8,10-12H,2,4H2,1H3/t6-,7-,8-/m0/s1
InChI key： ZZJSUXLVNPETPK-FXQIFTODSA-N
SMILES： CCOC(=O)C1=C[C@H](O)[C@H](O)[C@@H](O)C1
Systematic name  (3)：
  • (3S,4R,5S)-3,4,5-トリヒドロキシシクロヘキセン-1-カルボン酸エチル
  • エチル (3S,4R,5S)-3,4,5-トリヒドロキシシクロヘキサ-1-エン-1-カルボキシラート
  • ethyl (3S,4R,5S)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylate
Other name (1)：
  • (3S,4R,5S)-3,4,5-Trihydroxycyclohexene-1-carboxylic acid ethyl ester
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