| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:48 UTC |
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| Update Date | 2025-03-25 01:01:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02251237 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H9O5+ |
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| Molecular Mass | 257.0444 |
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| SMILES | O=c1ccc2[o+]c(-c3ccc(O)cc3)c(O)cc2o1 |
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| InChI Key | XRQKAZVHRXYWGL-UHFFFAOYSA-O |
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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 heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsbenzene and substituted derivativesheteroaromatic compoundshydrocarbon derivativeslactonesorganic cationsorganic oxidesorganooxygen compoundsoxacyclic compounds |
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| Substituents | monocyclic benzene moietyheteroaromatic compound1-hydroxy-2-unsubstituted benzenoidlactoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyranonephenolhydrocarbon derivativebenzenoidorganic cationorganooxygen compound |
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