| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:34 UTC |
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| Update Date | 2025-03-25 00:55:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02211915 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H19NO10 |
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| Molecular Mass | 337.1009 |
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| SMILES | CC(=O)NC1C(OC(C)C(=O)O)OC(C(=O)O)C(O)C(O)C1O |
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| InChI Key | QCSQGZGRNIMUJL-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 | oxepanes |
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| Subclass | oxepanes |
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| Direct Parent | oxepanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetalsacetamidesbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundssecondary alcoholssecondary carboxylic acid amides |
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| Substituents | alcoholcarbonyl groupcarboxylic acidhydroxy acidcarboxamide groupcarboxylic acid derivativeoxepaneoxacyclesecondary carboxylic acid amidebeta-hydroxy acidorganic oxideorganic oxygen compoundacetalaliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholdicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundacetamideorganooxygen compound |
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