| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:57:44 UTC |
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| Update Date | 2025-03-25 00:52:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02196035 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H15NO4 |
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| Molecular Mass | 177.1001 |
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| SMILES | CC1(CO)COC(O)(CN)CO1 |
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| InChI Key | KMZYZSOPZGPKFT-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 | dioxanes |
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| Subclass | 1,4-dioxanes |
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| Direct Parent | 1,4-dioxanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alcohols and polyolsdialkyl ethershemiacetalshydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | alcoholetherdialkyl etheroxacycleorganic oxygen compoundpara-dioxanealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhemiacetalhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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