| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:00:44 UTC |
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| Update Date | 2025-03-24 20:59:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01635381 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C6H3NO3 |
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| Molecular Mass | 137.0113 |
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| SMILES | O=C1Nc2ccoc2C1=O |
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| InChI Key | YLLIYPIBXYTWKB-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 | furans |
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| Subclass | furoic acid and derivatives |
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| Direct Parent | furoic acid and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl ketonesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundssecondary carboxylic acid amidesvinylogous amides |
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| Substituents | vinylogous amidecarbonyl groupfuroic acid or derivativeslactamazacycleheteroaromatic compoundcarboxamide groupcarboxylic acid derivativeketoneoxacyclesecondary carboxylic acid amideorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundaryl ketone |
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