| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:15 UTC |
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| Update Date | 2025-03-25 00:48:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02169850 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H11NO3 |
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| Molecular Mass | 217.0739 |
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| SMILES | CCNC1=C(O)C(=O)c2ccccc2C1=O |
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| InChI Key | RAMZUOMEUMQTKA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | naphthalenes |
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| Subclass | naphthoquinones |
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| Direct Parent | naphthoquinones |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl ketonesdialkylamineshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsquinonesvinylogous acidsvinylogous amides |
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| Substituents | vinylogous amidesecondary aliphatic aminearomatic homopolycyclic compoundsecondary amineketonevinylogous acidorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundnaphthoquinoneorganooxygen compoundaminearyl ketonequinone |
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