| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:01:45 UTC |
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| Update Date | 2025-03-24 14:09:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00774630 |
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| Frequency | 1.9 |
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| Structure | |
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| Chemical Formula | C6H7NO3 |
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| Molecular Mass | 141.0426 |
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| SMILES | O=C(NCO)c1ccco1 |
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| InChI Key | SBGQWANLKBVRJS-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 heteromonocyclic compounds |
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| Alternative Parents | 2-heteroaryl carboxamidesalkanolaminescarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary carboxylic acid amides |
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| Substituents | alcoholfuroic acid or derivativesaromatic heteromonocyclic compoundheteroaromatic compoundcarboxamide groupcarboxylic acid derivative2-heteroaryl carboxamideoxacyclesecondary carboxylic acid amideorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholorganooxygen compoundalkanolamine |
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