| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:16 UTC |
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| Update Date | 2025-03-21 18:02:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00036796 |
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| Frequency | 95.9 |
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| Structure | |
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| Chemical Formula | C6H6O2 |
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| Molecular Mass | 110.0368 |
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| SMILES | Cc1ccc(=O)oc1 |
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| InChI Key | TVJVIYLWQZECEQ-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 | pyrans |
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| Subclass | pyranones and derivatives |
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| Direct Parent | pyranones and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | heteroaromatic compoundshydrocarbon derivativeslactonesorganic oxidesorganooxygen compoundsoxacyclic compounds |
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| Substituents | lactoneoxacycleorganic oxideorganic oxygen compoundaromatic heteromonocyclic compoundheteroaromatic compoundpyranonehydrocarbon derivativeorganooxygen compound |
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