| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:43:18 UTC |
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| Update Date | 2025-03-25 00:47:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02163138 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H13Cl2NO2 |
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| Molecular Mass | 273.0323 |
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| SMILES | O=C(O)C1(c2ccc(Cl)c(Cl)c2)CCNCC1 |
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| InChI Key | KVEFIYFXOCNRSZ-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 | phenylpiperidines |
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| Direct Parent | phenylpiperidines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amino acidsaryl chloridesazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylaminesdichlorobenzeneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesorganopnictogen compoundspiperidinecarboxylic acids |
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| Substituents | monocyclic benzene moietycarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidorganochloridecarboxylic acid derivativeorganohalogen compoundorganic oxideorganonitrogen compoundorganopnictogen compoundpiperidinecarboxylic acid1,2-dichlorobenzenearyl chloridechlorobenzenesecondary aliphatic amineazacyclesecondary aminearyl halidemonocarboxylic acid or derivativesorganic oxygen compoundphenylpiperidinehydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneorganooxygen compoundamine |
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