| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:27 UTC |
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| Update Date | 2025-03-25 01:01:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02250427 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H6O4 |
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| Molecular Mass | 178.0266 |
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| SMILES | O=C1Cc2cc(C(=O)O)ccc2O1 |
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| InChI Key | LWJNVGVNVSMXJC-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 | benzenoidscarbonyl compoundscarboxylic acid esterscarboxylic acidscoumaransdicarboxylic acids and derivativeshydrocarbon derivativeslactonesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl groupcarboxylic acidbenzofuranonecarboxylic acid derivativelactoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundcarboxylic acid esterdicarboxylic acid or derivativeshydrocarbon derivativebenzenoidcoumaranorganooxygen compound |
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