Chem
J-GLOBAL ID：200907027211692559   Nikkaji number：J764.508B

4-Hydroxybenzoic acid [2-oxo-6,6aα-bis(acetoxymethyl)-3,3aα,4,6a-tetrahydro-2H-cyclopenta[b]furan]-4α-yl ester

4-ヒドロキシ安息香酸[2-オキソ-6,6aα-ビス(アセトキシメチル)-3,3aα,4,6a-テトラヒドロ-2H-シクロペンタ[b]フラン]-4α-イル
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： C20H20O9
Molecular formula furigana： C20-H20-O9
Molecular weight： 404.371
InChI： InChI=1S/C20H20O9/c1-11(21)26-9-14-7-17(28-19(25)13-3-5-15(23)6-4-13)16-8-18(24)29-20(14,16)10-27-12(2)22/h3-7,16-17,23H,8-10H2,1-2H3/t16-,17+,20+/m0/s1
InChI key： JKDKTEFYQMQNPR-SQGPQFPESA-N
SMILES： CC(=O)OCC1=C[C@@H](OC(=O)c2ccc(O)cc2)[C@@H]2CC(=O)O[C@]12COC(=O)C
Systematic name  (3)：
  • 4-ヒドロキシ安息香酸[2-オキソ-6,6aα-ビス(アセトキシメチル)-3,3aα,4,6a-テトラヒドロ-2H-シクロペンタ[b]フラン]-4α-イル
  • (3aS,4R,6aS)-6,6a-ビス[(アセチルオキシ)メチル]-2-オキソ-2H,3H,3aH,4H,6aH-シクロペンタ[b]フラン-4-イル 4-ヒドロキシベンゾアート
  • (3aS,4R,6aS)-6,6a-bis[(acetyloxy)methyl]-2-oxo-2H,3H,3aH,4H,6aH-cyclopenta[b]furan-4-yl 4-hydroxybenzoate
Other name (1)：
  • 4-Hydroxybenzoic acid [2-oxo-6,6aα-bis(acetoxymethyl)-3,3aα,4,6a-tetrahydro-2H-cyclopenta[b]furan]-4α-yl ester
Thsaurus map：
Thesaurus Map

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