| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:14 UTC |
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| Update Date | 2025-03-25 01:01:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02249924 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H13NO3 |
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| Molecular Mass | 231.0895 |
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| SMILES | COc1ccc2cc(C(O)C(N)=O)ccc2c1 |
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| InChI Key | VMPVOWMRSHTDLS-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 | naphthalenes |
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| Direct Parent | naphthalenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesaromatic alcoholscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidessecondary alcohols |
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| Substituents | aromatic alcoholprimary carboxylic acid amidealcoholphenol ethercarbonyl groupetheraromatic homopolycyclic compoundalkyl aryl ethercarboxamide groupcarboxylic acid derivativeorganic oxidenaphthaleneorganic oxygen compoundanisoleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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