Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:30:33 UTC |
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Update Date | 2025-03-21 18:41:38 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00135305 |
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Frequency | 18.6 |
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Structure | |
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Chemical Formula | C11H9O5+ |
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Molecular Mass | 221.0444 |
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SMILES | Oc1ccc(-c2ccc(O)c(O)[o+]2)cc1O |
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InChI Key | VWXVTFSOMTXWAI-UHFFFAOYSA-O |
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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 | 1-hydroxy-2-unsubstituted benzenoids |
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Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativesheteroaromatic compoundshydrocarbon derivativesorganic cationsorganooxygen compoundsoxacyclic compounds |
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Substituents | monocyclic benzene moietyaromatic heteromonocyclic compoundheteroaromatic compound1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidoxacycleorganic oxygen compoundhydrocarbon derivativeorganic cationorganoheterocyclic compoundorganooxygen compound |
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