| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:44 UTC |
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| Update Date | 2025-03-21 18:35:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00107278 |
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| Frequency | 25.1 |
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| Structure | |
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| Chemical Formula | C5H8NO4PS |
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| Molecular Mass | 208.9912 |
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| SMILES | O=P(O)(O)OCCc1nccs1 |
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| InChI Key | BQCIHLJXTJAZDI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | organic phosphoric acids and derivatives |
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| Subclass | phosphate esters |
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| Direct Parent | monoalkyl phosphates |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsthiazoles |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic oxideorganic oxygen compoundmonoalkyl phosphateorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundthiazoleorganoheterocyclic compoundorganooxygen compoundazole |
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