| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:05:00 UTC |
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| Update Date | 2025-03-21 20:46:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00354893 |
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| Frequency | 5.3 |
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| Structure | |
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| Chemical Formula | C6H11NO2 |
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| Molecular Mass | 129.079 |
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| SMILES | OCC(O)C1=NCCC1 |
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| InChI Key | JAPJZNDVBLTLCM-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 | pyrrolines |
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| Subclass | pyrrolines |
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| Direct Parent | pyrrolines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolsazacyclic compoundshydrocarbon derivativesketiminesorganopnictogen compoundsprimary alcoholspropargyl-type 1,3-dipolar organic compoundssecondary alcohols |
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| Substituents | alcoholketimineazacycleimineorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundpyrrolineorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholorganooxygen compound1,2-diol |
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