| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:58 UTC |
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| Update Date | 2025-03-25 00:53:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201227 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H17NO3 |
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| Molecular Mass | 235.1208 |
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| SMILES | COc1ccc(C(=O)N2CCC(O)CC2)cc1 |
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| InChI Key | SWGVRVQZOBEWNF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | piperidines |
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| Subclass | n-acylpiperidines |
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| Direct Parent | n-benzoylpiperidines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-benzoylpiperidinesalkyl aryl ethersanisolesazacyclic compoundsbenzamidescarboxylic acids and derivativeshydrocarbon derivativesmethoxybenzenesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsphenoxy compoundssecondary alcoholstertiary carboxylic acid amides |
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| Substituents | phenol ethermonocyclic benzene moietyether1-benzoylpiperidinearomatic heteromonocyclic compoundbenzoylalkyl aryl ethercarboxylic acid derivativebenzamideorganic oxidetertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundn-benzoylpiperidinealcoholazacyclebenzoic acid or derivativescarboxamide groupmethoxybenzeneorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compoundorganooxygen compound |
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