| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:07 UTC |
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| Update Date | 2025-03-21 18:05:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00057683 |
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| Frequency | 55.0 |
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| Structure | |
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| Chemical Formula | C8H15NO7 |
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| Molecular Mass | 237.0849 |
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| SMILES | CC(=O)NC1C(O)OOC(CO)C(O)C1O |
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| InChI Key | DJEBCKJMNIKSLW-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 | dioxepanes |
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| Subclass | 1,2-dioxepanes |
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| Direct Parent | 1,2-dioxepanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetamidescarbonyl compoundscarboxylic acids and derivativesdialkyl peroxideshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholssecondary carboxylic acid amides |
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| Substituents | alcoholcarbonyl groupcarboxamide groupcarboxylic acid derivative1,2-dioxepaneoxacyclesecondary carboxylic acid amideorganic oxideorganic oxygen compounddialkyl peroxidealiphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholacetamideorganooxygen compound |
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