| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:07:49 UTC |
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| Update Date | 2025-03-21 18:30:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00081006 |
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| Frequency | 35.8 |
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| Structure | |
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| Chemical Formula | C13H12O5 |
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| Molecular Mass | 248.0685 |
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| SMILES | Oc1cc(O)c2c(c1)OC(c1ccco1)C(O)C2 |
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| InChI Key | LLMUZUQMFXILBO-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 | 1-benzopyrans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersbenzenoidsfuransheteroaromatic compoundshydrocarbon derivativesoxacyclic compoundssecondary alcohols |
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| Substituents | alcoholfuranether1-benzopyranheteroaromatic compound1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidalkyl aryl etheroxacycleorganic oxygen compoundaromatic heteropolycyclic compoundsecondary alcoholhydrocarbon derivativebenzenoidorganooxygen compound |
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