| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:27 UTC |
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| Update Date | 2025-03-25 00:54:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02204589 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H8O4 |
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| Molecular Mass | 204.0423 |
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| SMILES | O=CCc1coc2cc(O)ccc2c1=O |
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| InChI Key | JBFLMXXWCVCERL-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 | benzopyrans |
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| Subclass | 1-benzopyrans |
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| Direct Parent | chromones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalpha-hydrogen aldehydesbenzenoidsheteroaromatic compoundshydrocarbon derivativesorganic oxidesoxacyclic compoundspyranones and derivatives |
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| Substituents | carbonyl groupheteroaromatic compound1-hydroxy-2-unsubstituted benzenoidaldehydeoxacycleorganic oxideorganic oxygen compoundchromonearomatic heteropolycyclic compoundalpha-hydrogen aldehydepyranpyranonehydrocarbon derivativebenzenoidorganooxygen compound |
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