| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:30:58 UTC |
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| Update Date | 2025-03-21 18:41:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00136286 |
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| Frequency | 18.4 |
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| Structure | |
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| Chemical Formula | C11H9NO3 |
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| Molecular Mass | 203.0582 |
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| SMILES | Nc1c(O)cccc1C(=O)c1ccco1 |
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| InChI Key | XHFOHQUYRUNJNA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl-phenylketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl ketonesbenzoyl derivativesfuroic acid and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundsprimary aminesvinylogous amides |
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| Substituents | furanmonocyclic benzene moietyaromatic heteromonocyclic compoundbenzoyl1-hydroxy-2-unsubstituted benzenoidorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundvinylogous amidefuroic acid or derivativesaryl-phenylketoneheteroaromatic compound1-hydroxy-4-unsubstituted benzenoidoxacyclephenolhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundamine |
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