| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:54:10 UTC |
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| Update Date | 2025-03-25 01:37:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02465199 |
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| Frequency | 0.5 |
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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 | CC(O)C1=NCCCO1 |
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| InChI Key | PPHGCGFZRZURPG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboximidic acids and derivatives |
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| Subclass | imidoesters |
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| Direct Parent | imidoesters |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspropargyl-type 1,3-dipolar organic compoundssecondary alcohols |
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| Substituents | alcoholazacycleorganic 1,3-dipolar compoundimido esterpropargyl-type 1,3-dipolar organic compoundoxacycleorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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