| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:54:04 UTC |
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| Update Date | 2025-03-21 18:04:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00048319 |
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| Frequency | 68.7 |
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| Structure | |
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| Chemical Formula | C8H10O4 |
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| Molecular Mass | 170.0579 |
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| SMILES | Cc1c(CO)cc(O)c(O)c1O |
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| InChI Key | MBOKLQQCUGRAIV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenols |
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| Subclass | benzenetriols and derivatives |
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| Direct Parent | pyrogallols and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaromatic alcoholsbenzyl alcoholshydrocarbon derivativesmeta cresolsortho cresolspara cresolstoluenes |
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| Substituents | aromatic alcoholalcoholmonocyclic benzene moietypyrogallol derivativem-cresol1-hydroxy-2-unsubstituted benzenoidbenzyl alcohol1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundorganic oxygen compoundp-cresolo-cresolhydrocarbon derivativetolueneorganooxygen compound |
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