Chem
J-GLOBAL ID：200907064578821781   Nikkaji number：J238.005F

(1β,2α)-1,2-Dihydro-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-6,8-dimethoxy-2,3-naphthalenedicarboxylic acid

(1β,2α)-1,2-ジヒドロ-7-ヒドロキシ-1-(4-ヒドロキシ-3,5-ジメトキシフェニル)-6,8-ジメトキシ-2,3-ナフタレンジカルボン酸
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： C22H22O10
Molecular formula furigana： C22-H22-O10
Molecular weight： 446.408
InChI： InChI=1S/C22H22O10/c1-29-12-7-10(8-13(30-2)18(12)23)15-16-9(5-11(21(25)26)17(15)22(27)28)6-14(31-3)19(24)20(16)32-4/h5-8,15,17,23-24H,1-4H3,(H,25,26)(H,27,28)/t15-,17-/m1/s1
InChI key： MQRBOKLXGOXXGG-NVXWUHKLSA-N
SMILES： COc1cc(cc(OC)c1O)[C@H]1[C@H](C(=O)O)C(=Cc2cc(OC)c(O)c(OC)c12)C(=O)O
Systematic name  (4)：
  • (1β,2α)-1,2-ジヒドロ-7-ヒドロキシ-1-(4-ヒドロキシ-3,5-ジメトキシフェニル)-6,8-ジメトキシ-2,3-ナフタレンジカルボン酸
  • (1R,2S)-1-(3,5-ジメトキシ-4-ヒドロキシフェニル)-6,8-ジメトキシ-7-ヒドロキシ-1,2-ジヒドロナフタレン-2,3-ジカルボン酸
  • (1R,2S)-7-ヒドロキシ-1-(4-ヒドロキシ-3,5-ジメトキシフェニル)-6,8-ジメトキシ-1,2-ジヒドロナフタレン-2,3-ジカルボン酸
  • (1R,2S)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-6,8-dimethoxy-1,2-dihydronaphthalene-2,3-dicarboxylic acid
Other name (2)：
  • (1β,2α)-1,2-Dihydro-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-6,8-dimethoxy-2,3-naphthalenedicarboxylic acid
  • (1R,2S)-1-(3,5-Dimethoxy-4-hydroxyphenyl)-6,8-dimethoxy-7-hydroxy-1,2-dihydronaphthalene-2,3-dicarboxylic acid
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