| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:41 UTC |
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| Update Date | 2025-03-21 18:37:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00114452 |
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| Frequency | 23.1 |
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| Structure | |
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| Chemical Formula | C8H18N2O11P2 |
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| Molecular Mass | 380.0386 |
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| SMILES | CC(=O)NC1C(N)OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O |
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| InChI Key | BPCLZCVJEDWLHG-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 heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolsacetamidescarbonyl compoundscarboxylic acids and derivativeshemiaminalshydrocarbon derivativesmonoalkyl phosphatesmonoalkylaminesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanessecondary alcoholssecondary carboxylic acid amides |
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| Substituents | carbonyl groupmonosaccharidecarboxylic acid derivativehemiaminalsaccharideorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneorganoheterocyclic compoundacetamide1,2-diolalcoholcarboxamide grouporganic pyrophosphateoxacyclesecondary carboxylic acid amidephosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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