| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:09:27 UTC |
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| Update Date | 2025-03-21 18:31:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00084822 |
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| Frequency | 33.8 |
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| Structure | |
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| Chemical Formula | C8H17NO12P2 |
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| Molecular Mass | 381.0226 |
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| SMILES | CC(=O)NC1C(O)C(O)C(O)C(O)C1OP(=O)(O)OP(=O)(O)O |
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| InChI Key | OAKLJLWQEYXIHQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organic oxoanionic compounds |
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| Subclass | organic pyrophosphates |
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| Direct Parent | organic pyrophosphates |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | acetamidescarbonyl compoundscarboxylic acids and derivativescyclitols and derivativescyclohexanolshydrocarbon derivativesmonoalkyl phosphatesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | alcoholcarbonyl groupcyclohexanolcyclitol or derivativescyclic alcoholcarboxamide groupcarboxylic acid derivativeorganic pyrophosphatesecondary carboxylic acid amideorganic oxidephosphoric acid estermonoalkyl phosphateorganonitrogen compoundsecondary alcoholaliphatic homomonocyclic compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateacetamideorganooxygen compound |
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