| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:18:34 UTC |
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| Update Date | 2025-03-24 20:16:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01391514 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C6H6N2O2 |
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| Molecular Mass | 138.0429 |
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| SMILES | NC(=O)c1cc(C=O)c[nH]1 |
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| InChI Key | JFPWNJIMCHGZGX-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 | pyrroles |
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| Subclass | pyrrole carboxylic acids and derivatives |
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| Direct Parent | pyrrole carboxamides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-heteroaryl carboxamidesaryl-aldehydesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsprimary carboxylic acid amidesvinylogous amides |
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| Substituents | primary carboxylic acid amidevinylogous amidearomatic heteromonocyclic compoundazacycleheteroaromatic compoundaldehydecarboxamide groupcarboxylic acid derivative2-heteroaryl carboxamideorganic oxidearyl-aldehydeorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativepyrrole-2-carboxamideorganic nitrogen compoundorganooxygen compound |
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