| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:56:32 UTC |
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| Update Date | 2025-03-24 21:50:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01911243 |
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| Frequency | 0.6 |
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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 | OC1CC2CNCC12 |
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| InChI Key | XFBQQBXIYXFYKY-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 | azacyclic compoundscyclic alcohols and derivativesdialkylamineshydrocarbon derivativesorganopnictogen compoundspyrrolidinessecondary alcohols |
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| Substituents | alcoholsecondary aliphatic amineazacyclesecondary aminealiphatic heteropolycyclic compoundazepaneorganic oxygen compoundcyclobutanolorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidineorganooxygen compoundamine |
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