Chem
J-GLOBAL ID：200907058344568632   Nikkaji number：J2.749.622I

D-2,3-Diketo-4-deoxy-epi-inositol

(3R,4S,5R)-3,4,5-トリヒドロキシ-1,2-シクロヘキサンジオン
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： C6H8O5
Molecular formula furigana： C6-H8-O5
Molecular weight： 160.125
InChI： InChI=1S/C6H8O5/c7-2-1-3(8)5(10)6(11)4(2)9/h2,4,6-7,9,11H,1H2/t2-,4+,6-/m1/s1
InChI key： SHFQRUVRUBHHRE-CJPQEGFPSA-N
SMILES： O[C@@H]1CC(=O)C(=O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • (3R,4S,5R)-3,4,5-トリヒドロキシ-1,2-シクロヘキサンジオン
  • (3R,4S,5R)-3,4,5-トリヒドロキシシクロヘキサン-1,2-ジオン
  • (3R,4S,5R)-3,4,5-trihydroxycyclohexane-1,2-dione
Other name (4)：
  • (3R,4S,5R)-3,4,5-Trihydroxy-1,2-cyclohexanedione
  • 3D-(3,5/4)-Trihydroxycyclohexane-1,2-dione
  • D-2,3-Diketo-4-deoxy-epi-inositol
  • 3,5/4-Trihydroxycyclohexa-1,2-dione
CAS registry number： 949461-91-0
KEGG COMPOUND： C04287
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