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CAS 87402-90-2

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(2R,2′R,2′′R,3S,3′S,3′′S,4S,4′R)-3,3′,3′′,4,4′,4′′-Hexahydro-2,2′,2′′-tris(3,4,5-trihydroxyphenyl)[4,8′:4′,8′′-ter-2H-1-benzopyran]-3,3′,3′′,5,5′,5′′,7,7′,7′′-nonol

Description:
The chemical substance with the name "(2R,2′R,2′′R,3S,3′S,3′′S,4S,4′R)-3,3′,3′′,4,4′,4′′-Hexahydro-2,2′,2′′-tris(3,4,5-trihydroxyphenyl)[4,8′:4′,8′′-ter-2H-1-benzopyran]-3,3′,3′′,5,5′,5′′,7,7′,7′′-nonol" and CAS number "87402-90-2" is a complex organic compound characterized by its intricate polyphenolic structure. This substance features multiple hydroxyl groups, which contribute to its potential antioxidant properties and solubility in polar solvents. The presence of multiple stereocenters indicates that it can exist in various stereoisomeric forms, which may influence its biological activity and interactions. The compound is likely to exhibit significant biological activity due to its structural features, which may include anti-inflammatory or neuroprotective effects. Its intricate arrangement of phenolic units suggests potential applications in pharmaceuticals or nutraceuticals, particularly in the context of health benefits associated with polyphenols. Overall, this compound exemplifies the complexity and diversity of natural products in chemistry, with potential implications for research and development in various fields.
Formula:C45H38O21
InChI:InChI=1S/C45H38O21/c46-15-7-18(48)30-29(8-15)64-42(13-3-24(54)37(60)25(55)4-13)39(62)34(30)32-20(50)11-21(51)33-35(40(63)43(66-45(32)33)14-5-26(56)38(61)27(57)6-14)31-19(49)10-17(47)16-9-28(58)41(65-44(16)31)12-1-22(52)36(59)23(53)2-12/h1-8,10-11,28,34-35,39-43,46-63H,9H2/t28-,34-,35+,39-,40-,41+,42+,43+/m0/s1
InChI key:InChIKey=NVTLDVSBUJGIAD-QHBXHTPSSA-N
SMILES:OC1=C2C(=C(C(O)=C1)[C@@H]3C=4C(O[C@@H]([C@H]3O)C5=CC(O)=C(O)C(O)=C5)=CC(O)=CC4O)O[C@@H]([C@@H](O)[C@@H]2C6=C7C(C[C@H](O)[C@H](O7)C8=CC(O)=C(O)C(O)=C8)=C(O)C=C6O)C9=CC(O)=C(O)C(O)=C9
Synonyms:
  • (2R,2′R,2′′R,3S,3′S,3′′S,4S,4′R)-3,3′,3′′,4,4′,4′′-Hexahydro-2,2′,2′′-tris(3,4,5-trihydroxyphenyl)[4,8′:4′,8′′-ter-2H-1-benzopyran]-3,3′,3′′,5,5′,5′′,7,7′,7′′-nonol
  • [4,8′:4′,8′′-Ter-2H-1-benzopyran]-3,3′,3′′,5,5′,5′′,7,7′,7′′-nonol, 3,3′,3′′,4,4′,4′′-hexahydro-2,2′,2′′-tris(3,4,5-trihydroxyphenyl)-, (2R,2′R,2′′R,3S,3′S,3′′S,4S,4′R)-
  • [4,8′:4′,8′′-Ter-2H-1-benzopyran]-3,3′,3′′,5,5′,5′′,7,7′,7′′-nonol, 3,3′,3′′,4,4′,4′′-hexahydro-2,2′,2′′-tris(3,4,5-trihydroxyphenyl)-, [2R-[2α,3β,4α[2′R*,3′S*,4′R*(2′′R*,3′′S*)]]]-
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