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Subst1-(7-21)-+
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b-D-Glcp-(1-4)-+ |
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b-D-Glcp-(1-2)-a-L-Arap-(1-3)-Subst
Subst = avenacin A aglycon core = SMILES C[C@]12CC{3}[C@H](O)[C@@](C)({23}CO)[C@@H]1CC[C@]3(C)[C@@H]2C[C@@H]4[C@@]5(O4)[C@@]3(C)C{16}[C@H](O)[C@]6(C)[C@H]5C[C@@](C)(C=O){21}[C@@H](O)C6;
Subst1 = 2-methylaminobenzoic acid = SMILES O={7}C(O)C1=CC=CC=C1NC |
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