| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:56 UTC |
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| Update Date | 2025-03-25 00:50:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02180667 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H23NO3 |
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| Molecular Mass | 313.1678 |
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| SMILES | Oc1cccc(CC2CCNCC2Cc2ccc(O)c(O)c2)c1 |
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| InChI Key | FLGVRPBZDNXHCQ-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 | benzylpiperidines |
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| Direct Parent | 3-benzylpiperidines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids4-benzylpiperidinesazacyclic compoundsbenzene and substituted derivativesdialkylamineshydrocarbon derivativesorganooxygen compoundsorganopnictogen compounds |
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| Substituents | secondary aliphatic aminemonocyclic benzene moietyaromatic heteromonocyclic compoundazacycle1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidsecondary amine3-benzylpiperidineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundphenolhydrocarbon derivativebenzenoidorganic nitrogen compound4-benzylpiperidineorganooxygen compoundamine |
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