| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:41 UTC |
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| Update Date | 2025-03-25 01:01:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02248682 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H14ClN3O3 |
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| Molecular Mass | 259.0724 |
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| SMILES | Cn1c(=N)ccn(C2CC(Cl)C(CO)O2)c1=O |
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| InChI Key | DCCYYYDRDSDJME-UHFFFAOYSA-N |
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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 | diazines |
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| Subclass | pyrimidines and pyrimidine derivatives |
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| Direct Parent | pyrimidones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkyl chloridesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsorganic oxidesorganochloridesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholstetrahydrofuransureas |
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| Substituents | aromatic heteromonocyclic compoundalkyl chlorideorganochloridepyrimidoneorganohalogen compoundureaorganic oxideorganonitrogen compoundorganopnictogen compoundalkyl halideprimary alcoholimidolactamalcoholcarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundoxacycleorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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