| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:29 UTC |
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| Update Date | 2025-03-21 18:06:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00065681 |
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| Frequency | 46.6 |
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| Structure | |
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| Chemical Formula | C14H15ClN6O |
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| Molecular Mass | 318.0996 |
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| SMILES | Nc1nc2c(c(=O)[nH]1)N1CN(c3ccc(Cl)cc3)CC1CN2 |
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| InChI Key | HHDYDCILBJLODQ-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 | pteridines and derivatives |
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| Subclass | pterins and derivatives |
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| Direct Parent | pterins and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aniline and substituted anilinesaryl chloridesazacyclic compoundschlorobenzenesdialkylarylaminesheteroaromatic compoundshydrocarbon derivativesimidazopyrazinesimidolactamslactamsorganic oxidesorganochloridesorganooxygen compoundsorganopnictogen compoundsphenylimidazolidinesprimary aminespyrimidonessecondary alkylarylaminesvinylogous amides |
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| Substituents | imidazolidinemonocyclic benzene moietylactamphenylimidazolidineimidazopyrazineorganochloridepyrimidoneorganohalogen compoundpyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compounddialkylarylamineimidolactamaryl chloridechlorobenzenevinylogous amidepterinazacycleaniline or substituted anilinesheteroaromatic compoundsecondary aminesecondary aliphatic/aromatic aminearyl halideorganic oxygen compoundhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundhalobenzeneamineorganooxygen compound |
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