Chem
J-GLOBAL ID：200907071921788015   Nikkaji number：J2.525.255A

4α,5β-Dihydroxycycloheptane-1,1-dicarboxylic acid dimethyl ester

4α,5β-ジヒドロキシシクロヘプタン-1,1-ジカルボン酸ジメチル
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： C11H18O6
Molecular formula furigana： C11-H18-O6
Molecular weight： 246.259
InChI： InChI=1S/C11H18O6/c1-16-9(14)11(10(15)17-2)5-3-7(12)8(13)4-6-11/h7-8,12-13H,3-6H2,1-2H3/t7-,8-/m0/s1
InChI key： GSECBVLUVAIMEK-YUMQZZPRSA-N
SMILES： COC(=O)C1(CC[C@H](O)[C@@H](O)CC1)C(=O)OC
Systematic name  (3)：
  • 4α,5β-ジヒドロキシシクロヘプタン-1,1-ジカルボン酸ジメチル
  • 1,1-ジメチル (4S,5S)-4,5-ジヒドロキシシクロヘプタン-1,1-ジカルボキシラート
  • 1,1-dimethyl (4S,5S)-4,5-dihydroxycycloheptane-1,1-dicarboxylate
Other name (1)：
  • 4α,5β-Dihydroxycycloheptane-1,1-dicarboxylic acid dimethyl ester
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