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Subst-(1-3)-+
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Subst-(1-2)-b-D-Glcp4Me-(1-3)-Subst1
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Subst-(1-6)-+
Subst = 4-bromobenzoic acid = SMILES O={1}C(O)c1ccc(Br)cc1;
Subst1 = ascosteroside C aglycon = SMILES C=C(CC[C@@H](C)[C@H]1C{15}[C@@H](O)[C@@]2({30}C(=O)O)/C4=C(CC[C@]12C)/[C@@]3(C)CC{3}[C@H](O)C(=C)[C@@H]3CC4)C(C)C |
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