| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:08 UTC |
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| Update Date | 2025-03-25 00:58:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02233579 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H25NO3 |
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| Molecular Mass | 315.1834 |
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| SMILES | CCC1=C(C)C(=O)NC1Cc1ccc(C)c(C)c1CCC(=O)O |
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| InChI Key | AMZWPHZZEIHNIN-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | phenylpropanoic acids |
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| Subclass | phenylpropanoic acids |
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| Direct Parent | phenylpropanoic acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolinessecondary carboxylic acid amideso-xylenes |
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| Substituents | monocyclic benzene moietycarbonyl grouplactamcarboxylic acidaromatic heteromonocyclic compoundazacycle3-phenylpropanoic-acidcarboxamide groupcarboxylic acid derivativexylenesecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativeso-xyleneorganic oxygen compoundpyrrolineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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