Chem
J-GLOBAL ID:200907080487135899   Nikkaji number:J653.578J

2,2′-[[[(1R)-1β-(3,4-Dihydroxyphenyl)-6,7-dihydroxy-1,2-dihydronaphthalene]-2,3-diyl]bis(carbonyloxy)]bis[(R)-3-(3,4-dihydroxyphenyl)propionic acid potassium] salt

2,2′-[[[(1R)-1β-(3,4-ジヒドロキシフェニル)-6,7-ジヒドロキシ-1,2-ジヒドロナフタレン]-2,3-ジイル]ビス(カルボニルオキシ)]ビス[(R)-3-(3,4-ジヒドロキシフェニル)プロピオン酸カリウム]
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: C36H28K2O16
Molecular formula furigana: C36-H28-K2-O16
Molecular weight: 794.801
InChI: InChI=1S/C36H30O16.2K/c37-21-4-1-15(7-24(21)40)9-29(33(45)46)51-35(49)20-11-18-13-27(43)28(44)14-19(18)31(17-3-6-23(39)26(42)12-17)32(20)36(50)52-30(34(47)48)10-16-2-5-22(38)25(41)8-16;;/h1-8,11-14,29-32,37-44H,9-10H2,(H,45,46)(H,47,48);;/q;2*+1/p-2/t29-,30-,31-,32?;;/m1../s1
InChI key: YYHRLIRLQRUSRG-CFHFNVEYSA-L
SMILES: Oc1ccc(C[C@@H](OC(=O)C2[C@H](c3ccc(O)c(O)c3)c3cc(O)c(O)cc3C=C2C(=O)O[C@H](Cc2ccc(O)c(O)c2)C(=O)O[K])C(=O)O[K])cc1O
Systematic name  (3):
  • 2,2′-[[[(1R)-1β-(3,4-ジヒドロキシフェニル)-6,7-ジヒドロキシ-1,2-ジヒドロナフタレン]-2,3-ジイル]ビス(カルボニルオキシ)]ビス[(R)-3-(3,4-ジヒドロキシフェニル)プロピオン酸カリウム]
  • カリウム (2R)-3-(3,4-ジヒドロキシフェニル)-2-[(1R)-1-(3,4-ジヒドロキシフェニル)-3-({[(2R)-3-(3,4-ジヒドロキシフェニル)-1-オキソ-1-(ポタッシオオキシ)プロパン-2-イル]オキシ}カルボニル)-6,7-ジヒドロキシ-1,2-ジヒドロナフタレン-2-カルボニルオキシ]プロパノアート
  • potassium (2R)-3-(3,4-dihydroxyphenyl)-2-[(1R)-1-(3,4-dihydroxyphenyl)-3-({[(2R)-3-(3,4-dihydroxyphenyl)-1-oxo-1-(potassiooxy)propan-2-yl]oxy}carbonyl)-6,7-dihydroxy-1,2-dihydronaphthalene-2-carbonyloxy]propanoate
Other name (1):
  • 2,2′-[[[(1R)-1β-(3,4-Dihydroxyphenyl)-6,7-dihydroxy-1,2-dihydronaphthalene]-2,3-diyl]bis(carbonyloxy)]bis[(R)-3-(3,4-dihydroxyphenyl)propionic acid potassium] salt
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