| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:45 UTC |
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| Update Date | 2025-03-25 00:56:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02221596 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H7BrO4 |
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| Molecular Mass | 269.9528 |
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| SMILES | O=C(O)CC1C(=O)Oc2cc(Br)ccc21 |
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| InChI Key | ZYOLYRWOGKDPFT-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 | benzofuranones |
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| Direct Parent | benzofuranones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl bromidesbenzenoidscarbonyl compoundscarboxylic acid esterscarboxylic acidscoumaransdicarboxylic acids and derivativeshydrocarbon derivativeslactonesorganic oxidesorganobromidesoxacyclic compounds |
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| Substituents | carbonyl groupcarboxylic acidbenzofuranonecarboxylic acid derivativeorganohalogen compoundaryl halidelactoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundcarboxylic acid esterdicarboxylic acid or derivativesorganobromidehydrocarbon derivativebenzenoidaryl bromidecoumaranorganooxygen compound |
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