Chem
J-GLOBAL ID：200907020202387773   Nikkaji number：J1.515.570A

3,4,5-Trihydroxybenzoic acid (2R)-2α-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3α-yl ester

3,4,5-トリヒドロキシ安息香酸(2R)-2α-(3,4-ジヒドロキシフェニル)-3,4-ジヒドロ-2H-1-ベンゾピラン-3α-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： C22H18O8
Molecular formula furigana： C22-H18-O8
Molecular weight： 410.378
InChI： InChI=1S/C22H18O8/c23-14-6-5-12(7-15(14)24)21-19(10-11-3-1-2-4-18(11)29-21)30-22(28)13-8-16(25)20(27)17(26)9-13/h1-9,19,21,23-27H,10H2/t19-,21-/m1/s1
InChI key： MQKFHQCYSXMFBB-TZIWHRDSSA-N
SMILES： Oc1ccc(cc1O)[C@H]1Oc2ccccc2C[C@H]1OC(=O)c1cc(O)c(O)c(O)c1
Systematic name  (3)：
  • 3,4,5-トリヒドロキシ安息香酸(2R)-2α-(3,4-ジヒドロキシフェニル)-3,4-ジヒドロ-2H-1-ベンゾピラン-3α-イル
  • (2R,3R)-2-(3,4-ジヒドロキシフェニル)-3,4-ジヒドロ-2H-1-ベンゾピラン-3-イル 3,4,5-トリヒドロキシベンゾアート
  • (2R,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate
Other name (1)：
  • 3,4,5-Trihydroxybenzoic acid (2R)-2α-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3α-yl ester
Thsaurus map：
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