| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:09:37 UTC |
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| Update Date | 2025-03-21 18:31:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00085210 |
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| Frequency | 33.6 |
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| Structure | |
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| Chemical Formula | C13H20N4O4PS+ |
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| Molecular Mass | 359.0937 |
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| SMILES | CCOP(=O)(O)OCc1sc[n+](Cc2cnc(C)nc2N)c1C |
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| InChI Key | CAGVRSBZKVFFGS-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | azoles |
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| Subclass | thiazoles |
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| Direct Parent | 4,5-disubstituted thiazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkyl phosphatesheteroaromatic compoundshydrocarbon derivativesimidolactamsorganic cationsorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminespyrimidines and pyrimidine derivatives |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compound4,5-disubstituted 1,3-thiazolepyrimidinedialkyl phosphateorganic oxideorganic oxygen compoundphosphoric acid esterorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic cationimidolactamorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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