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Secoiridoid glucoside gl5
SpectraBase Compound ID GcxhrhPORlc
InChI InChI=1S/C42H54O22/c1-5-21-23(25(37(53)55-3)17-58-39(21)63-41-35(51)33(49)31(47)27(15-43)61-41)13-29(45)57-12-11-19-7-9-20(10-8-19)60-30(46)14-24-22(6-2)40(59-18-26(24)38(54)56-4)64-42-36(52)34(50)32(48)28(16-44)62-42/h5-10,17-18,23-24,27-28,31-36,39-44,47-52H,11-16H2,1-4H3/b21-5+,22-6+/t23?,24?,27-,28-,31-,32-,33+,34+,35-,36-,39?,40?,41+,42+/m1/s1
InChIKey ALDOLERJIYTYDY-PVYNOKHTSA-N
Mol Weight 910.9 g/mol
Molecular Formula C42H54O22
Exact Mass 910.310673 g/mol
Enantiomer InChIKey ALDOLERJIYTYDY-AYNAYMBPSA-N
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Solvent D2O

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