| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:36 UTC |
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| Update Date | 2025-03-21 18:36:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00109369 |
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| Frequency | 24.5 |
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| Structure | |
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| Chemical Formula | C7H9N3O3 |
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| Molecular Mass | 183.0644 |
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| SMILES | CC(=O)NC1=C(N)N(C)C(=O)C1=O |
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| InChI Key | XITIHXYBRGBVGT-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 | pyrrolines |
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| Direct Parent | pyrrolines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetamidesazacyclic compoundscarboxylic acids and derivativescyclic ketoneshydrocarbon derivativeslactamsmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidestertiary carboxylic acid amidesvinylogous amides |
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| Substituents | vinylogous amidecarbonyl grouplactamazacyclecyclic ketonecarboxamide groupcarboxylic acid derivativeketonesecondary carboxylic acid amideorganic oxideorganic oxygen compoundpyrrolinetertiary carboxylic acid amidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundacetamideorganooxygen compound |
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