| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:40:07 UTC |
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| Update Date | 2025-03-21 17:58:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00015661 |
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| Frequency | 276.5 |
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| Structure | |
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| Chemical Formula | C9H6O3 |
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| Molecular Mass | 162.0317 |
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| SMILES | O=C(O)c1coc2ccccc12 |
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| InChI Key | BENJFDPHDCGUAQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | benzofurans |
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| Subclass | benzofurans |
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| Direct Parent | benzofurans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compoundsbenzenoidsfuran-3-carboxylic acidsfuroic acidsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsoxacyclic compounds |
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| Substituents | furanfuroic acid or derivativesfuran-3-carboxylic acidcarboxylic acidbenzofuranheteroaromatic compoundcarboxylic acid derivativefuroic acidoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundhydrocarbon derivativebenzenoid1-carboxy-2-haloaromatic compoundfuran-3-carboxylic acid or derivativesorganooxygen compound |
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