| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:02 UTC |
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| Update Date | 2025-03-21 18:38:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00122434 |
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| Frequency | 21.1 |
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| Structure | |
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| Chemical Formula | C5H9NO7P2S |
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| Molecular Mass | 288.9575 |
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| SMILES | Cc1ncc(COP(=O)(O)OP(=O)(O)O)s1 |
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| InChI Key | QZBMOLYXEIRWDE-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 | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2,5-disubstituted thiazolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonoalkyl phosphatesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | 2,5-disubstituted 1,3-thiazolearomatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic pyrophosphateorganic oxidephosphoric acid estermonoalkyl phosphateorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundthiazoleorganic phosphoric acid derivativealkyl phosphateorganoheterocyclic compoundorganooxygen compoundazole |
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