| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:40 UTC |
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| Update Date | 2025-03-25 01:01:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02246362 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H9N3O4 |
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| Molecular Mass | 235.0593 |
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| SMILES | CC1=C(C=O)NC(=O)C1c1c[nH]c(=O)[nH]c1=O |
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| InChI Key | WBCGGUNMPACMFN-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 | pyrrolines |
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| Subclass | pyrroline carboxylic acids and derivatives |
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| Direct Parent | pyrroline carboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aldehydesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrimidonessecondary carboxylic acid amidesvinylogous amides |
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| Substituents | vinylogous amidecarbonyl groupcarbonic acid derivativelactamaromatic heteromonocyclic compoundazacyclepyrroline carboxylic acid or derivativesheteroaromatic compoundpyrimidonealdehydecarboxamide groupcarboxylic acid derivativepyrimidinesecondary carboxylic acid amideorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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