| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:09 UTC |
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| Update Date | 2025-03-25 00:51:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02187993 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H16N4O2 |
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| Molecular Mass | 248.1273 |
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| SMILES | CC(=O)NCCC(=O)c1ccc(NC(=N)N)cc1 |
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| InChI Key | PYDQFCAFLSFTIP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | alkyl-phenylketones |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acetamidesaryl alkyl ketonesbenzoyl derivativescarboximidamidescarboxylic acids and derivativesguanidineshydrocarbon derivativesiminesorganic oxidesorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | monocyclic benzene moietyaryl alkyl ketoneguanidineiminebenzoylcarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundacetamidecarboximidamidecarboxamide grouparomatic homomonocyclic compoundsecondary carboxylic acid amidehydrocarbon derivativebenzenoidorganic nitrogen compoundalkyl-phenylketone |
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