| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:13 UTC |
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| Update Date | 2025-03-25 00:57:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02224915 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H14N2O2 |
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| Molecular Mass | 230.1055 |
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| SMILES | NCCCNC1=CC(=O)c2ccccc2C1=O |
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| InChI Key | RJANLGYBGHUOHW-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 derivativesmonoalkylaminesorganic oxidesorganooxygen compoundsorganopnictogen compoundsquinonesvinylogous amides |
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| Substituents | vinylogous amidesecondary aliphatic aminearomatic homopolycyclic compoundsecondary amineketoneorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundnaphthoquinoneorganooxygen compoundaminearyl ketonequinone |
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