| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:37 UTC |
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| Update Date | 2025-03-25 00:51:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02184409 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H10N3O4PS |
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| Molecular Mass | 239.013 |
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| SMILES | NC(Cc1c[nH]c(=S)[nH]1)OP(=O)(O)O |
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| InChI Key | PPXNDAYPLKRWEQ-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 derivativesimidazolesimidazolethionesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsthioureas |
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| Substituents | thioureaaromatic heteromonocyclic compoundazacycleheteroaromatic compoundimidazole-2-thioneorganosulfur compoundorganic oxideorganic oxygen compoundimidazolemonoalkyl phosphateorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundazole |
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