| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:17 UTC |
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| Update Date | 2025-03-21 18:36:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00111061 |
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| Frequency | 24.0 |
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| Structure | |
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| Chemical Formula | C11H16N4O5P+ |
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| Molecular Mass | 315.0853 |
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| SMILES | Cc1ncc(C[n+]2coc(COP(=O)(O)O)c2C)c(N)n1 |
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| InChI Key | MDANLGFNUDISER-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 | oxazoles |
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| Direct Parent | 4,5-disubstituted oxazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmonoalkyl phosphatesorganic cationsorganic oxidesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundsprimary aminespyrimidines and pyrimidine derivatives |
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| Substituents | aromatic heteromonocyclic compoundpyrimidineorganic oxideorganonitrogen compoundorganopnictogen compoundorganic cationimidolactamazacycleheteroaromatic compound4,5-disubstituted 1,3-oxazoleoxacycleorganic oxygen compoundphosphoric acid estermonoalkyl phosphatehydrocarbon derivativeprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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