| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:17:00 UTC |
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| Update Date | 2025-03-24 14:15:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00811101 |
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| Frequency | 1.8 |
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| Structure | |
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| Chemical Formula | C8H13NO |
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| Molecular Mass | 139.0997 |
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| SMILES | C=CC1(O)CN2CCCC21 |
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| InChI Key | ZRMQHBFTJDQQJC-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 compoundsazetidineshydrocarbon derivativesn-alkylpyrrolidinesorganopnictogen compoundstertiary alcoholstrialkylamines |
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| Substituents | alcoholazacyclen-alkylpyrrolidinetertiary aliphatic amineazetidinealiphatic heteropolycyclic compoundtertiary alcoholazepaneorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidineaminetertiary amineorganooxygen compound |
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