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Substance Name: D-Glucopyranose, pentakis(3,4,5-trihydroxybenzoate)
RN: 40410-94-4
InChIKey: QJYNZEYHSMRWBK-PPPHSYQWSA-N

Molecular Formula

  • C41-H32-O26

Molecular Weight

  • 940.6778
 
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Names and Synonyms

  • D-Glucopyranose, pentakis(3,4,5-trihydroxybenzoate)

Registry Numbers

CAS Registry Number

  • 40410-94-4

System Generated Number

  • 0040410944

Structure Descriptors

InChI

1S/C41H32O26/c42-17-1-12(2-18(43)28(17)52)36(57)62-11-27-33(64-37(58)13-3-19(44)29(53)20(45)4-13)34(65-38(59)14-5-21(46)30(54)22(47)6-14)35(66-39(60)15-7-23(48)31(55)24(49)8-15)41(63-27)67-40(61)16-9-25(50)32(56)26(51)10-16/h1-10,27,33-35,41-56H,11H2/t27-,33-,34+,35-,41?/m1/s1

InChIKey

QJYNZEYHSMRWBK-PPPHSYQWSA-N

Smiles

[C@H]1([C@H]([C@@H]([C@H](OC1OC(=O)c1cc(c(c(c1)O)O)O)COC(=O)c1cc(c(c(c1)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O