| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:26:43 UTC |
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| Update Date | 2025-03-21 20:55:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00406177 |
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| Frequency | 4.5 |
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| Structure | |
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| Chemical Formula | C6H11NO |
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| Molecular Mass | 113.0841 |
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| SMILES | OC1CN2CCCC12 |
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| InChI Key | QCPYBMJLUQXDAW-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 | azepanes |
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| Subclass | azepanes |
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| Direct Parent | azepanes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsazacyclic compoundsazetidineshydrocarbon derivativesn-alkylpyrrolidinesorganopnictogen compoundssecondary alcoholstrialkylamines |
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| Substituents | alcoholazacyclen-alkylpyrrolidine1,2-aminoalcoholtertiary aliphatic amineazetidinealiphatic heteropolycyclic compoundazepaneorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidineaminetertiary amineorganooxygen compound |
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