| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:13:03 UTC |
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| Update Date | 2025-03-21 18:32:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00093345 |
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| Frequency | 29.9 |
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| Structure | |
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| Chemical Formula | C8H8O2 |
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| Molecular Mass | 136.0524 |
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| SMILES | Cc1c(O)cccc1C=O |
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| InChI Key | ZRYCRPNCXLQHPN-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | hydroxybenzaldehydes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzoyl derivativeshydrocarbon derivativesorganic oxidesorganooxygen compoundsortho cresolstoluenes |
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| Substituents | monocyclic benzene moietybenzoyl1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundorganic oxideo-cresolphenolhydrocarbon derivativebenzenoidhydroxybenzaldehydetoluene |
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