Dateien nach "xyz" hochladen
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xyz/smiles.txt
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xyz/smiles.txt
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Cinnamicacid:
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OC(=O)\C=C\c1ccccc1
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m-Coumaricacid:
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OC(/C=C/C1=CC=CC(O)=C1)=O
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p-Coumaricacid:
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OC(=O)\C=C\c1ccc(O)cc1
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Benzaldehyd:
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O=Cc1ccccc1
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Caffeicacid:
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OC(=O)\C=C\c1ccc(O)c(O)c1
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3-Hydroxybenzaldehyd:
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Oc1cccc(C=O)c1
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4-Hydroxybenzaldehyd:
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[H]C(=O)c1ccc(O)cc1
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3,4-Dihydroxybenzaldehyd:
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Oc1ccc(C=O)cc1O
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