| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:07 UTC |
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| Update Date | 2025-03-25 00:45:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02151407 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H16N4O |
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| Molecular Mass | 244.1324 |
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| SMILES | N#Cc1ccc(C2(O)CCN(C(=N)N)CC2)cc1 |
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| InChI Key | SMWPSCYGMAOHDN-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 | azacyclic compoundsbenzonitrilescarboximidamidesguanidineshydrocarbon derivativesiminesnitrilesorganopnictogen compoundstertiary alcohols |
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| Substituents | alcoholmonocyclic benzene moietynitrilearomatic heteromonocyclic compoundazacycleguanidineiminecarboximidamidebenzonitriletertiary alcoholorganic oxygen compoundphenylpiperidineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundcarbonitrileorganooxygen compound |
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