| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:06 UTC |
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| Update Date | 2025-03-21 18:02:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00036393 |
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| Frequency | 97.2 |
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| Structure | |
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| Chemical Formula | C6H4O3 |
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| Molecular Mass | 124.016 |
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| SMILES | O=CC(=O)c1ccco1 |
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| InChI Key | LPLMJMMVZNCODI-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 | furans |
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| Subclass | furoic acid and derivatives |
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| Direct Parent | furoic acid and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha ketoaldehydesaryl ketonesheteroaromatic compoundshydrocarbon derivativesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl groupfuroic acid or derivativesaromatic heteromonocyclic compoundheteroaromatic compoundaldehydeketoneoxacycleorganic oxideorganic oxygen compoundhydrocarbon derivativealpha-ketoaldehydeorganooxygen compoundaryl ketone |
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