SpectraBase Compound ID | 3w6q2UcQYDX |
---|---|
InChI | InChI=1S/C94H90N4O29/c1-113-91-79(125-88(108)64-43-25-10-26-44-64)76(122-85(105)61-37-19-7-20-38-61)73(119-82(102)58-31-13-4-14-32-58)67(116-91)55-95-70(99)49-52-94(98(111)112,53-50-71(100)96-56-68-74(120-83(103)59-33-15-5-16-34-59)77(123-86(106)62-39-21-8-22-40-62)80(92(114-2)117-68)126-89(109)65-45-27-11-28-46-65)54-51-72(101)97-57-69-75(121-84(104)60-35-17-6-18-36-60)78(124-87(107)63-41-23-9-24-42-63)81(93(115-3)118-69)127-90(110)66-47-29-12-30-48-66/h4-48,67-69,73-81,91-93H,49-57H2,1-3H3,(H,95,99)(H,96,100)(H,97,101)/t67-,68-,69-,73-,74-,75-,76+,77+,78+,79+,80+,81+,91+,92+,93+/m0/s1 |
InChIKey | LDJHFEFHCPZZGG-QYTWMCDOSA-N |
Mol Weight | 1739.8 g/mol |
Molecular Formula | C94H90N4O29 |
Exact Mass | 1738.569073 g/mol |
Enantiomer InChIKey | LDJHFEFHCPZZGG-CIEHWJCLSA-N |
Title | Journal or Book | Year |
---|---|---|
Multivalent ligands for the mannose-specific lectin on type 1 fimbriae of Escherichia coli : syntheses and testing of trivalent α-D-mannoside clusters | Journal of the Chemical Society, Perkin Transactions 1 | 1998 |
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