| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:48:45 UTC |
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| Update Date | 2025-03-25 00:49:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02175625 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H22NO3+ |
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| Molecular Mass | 264.1594 |
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| SMILES | CC(C)C(=O)OC(C(=O)[N+](C)(C)C)c1ccccc1 |
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| InChI Key | OWLDHALQYGAOLJ-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 | benzene and substituted derivatives |
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| Subclass | benzyloxycarbonyls |
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| Direct Parent | benzyloxycarbonyls |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsphenylacetamides |
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| Substituents | benzyloxycarbonylcarbonyl groupcarboxylic acid derivativearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationphenylacetamideorganooxygen compound |
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