| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:57:26 UTC |
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| Update Date | 2025-03-21 18:05:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00056061 |
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| Frequency | 56.9 |
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| Structure | |
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| Chemical Formula | C5H3BrO3 |
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| Molecular Mass | 189.9266 |
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| SMILES | O=C(O)c1ccc(Br)o1 |
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| InChI Key | YVTQHZDUDUCGRD-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 acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl bromidescarboxylic acidsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganobromidesorganooxygen compoundsoxacyclic compounds |
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| Substituents | carboxylic acidaromatic heteromonocyclic compoundheteroaromatic compoundcarboxylic acid derivativeorganohalogen compoundfuroic acidaryl halideoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganobromidehydrocarbon derivativearyl bromideorganooxygen compound |
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