| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:38 UTC |
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| Update Date | 2025-03-21 18:39:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00123778 |
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| Frequency | 20.8 |
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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 | Cc1ncc(CC[n+]2csc(CCOP(=O)(O)O)c2C)c(N)n1 |
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| InChI Key | LBVSVXZPONHUSV-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 compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmonoalkyl phosphatesorganic cationsorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminespyrimidines and pyrimidine derivatives |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compound4,5-disubstituted 1,3-thiazolepyrimidineorganic oxideorganic oxygen compoundphosphoric acid estermonoalkyl phosphateorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic cationimidolactamorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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