| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:46:56 UTC |
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| Update Date | 2025-03-24 20:53:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01602170 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C47H93N2O19P3 |
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| Molecular Mass | 1082.5585 |
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| SMILES | CCCCCCCCCCCC(O)CC(=O)NC1C(OP(=O)(O)O)OC(OP(=O)(O)OP(=O)(O)O)C(NC(=O)CC(O)CCCCCCCCCCC)C1OC(=O)CC(O)CCCCCCCCCCC |
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| InChI Key | KZRGGMNKTARYHY-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 | beta hydroxy acids and derivativescarbonyl compoundscarboxylic acid estersfatty acid estershydrocarbon derivativesmonoalkyl phosphatesmonocarboxylic acids and derivativesmonosaccharidesn-acyl aminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanessecondary alcoholssecondary carboxylic acid amides |
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| Substituents | fatty acylcarbonyl groupfatty amidemonosaccharidecarboxylic acid derivativebeta-hydroxy acidsaccharideorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneorganoheterocyclic compoundalcoholhydroxy acidcarboxamide groupn-acyl-amineorganic pyrophosphateoxacyclesecondary carboxylic acid amidefatty acid estermonocarboxylic acid or derivativesphosphoric acid estermonoalkyl phosphatecarboxylic acid estersecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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