| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:58 UTC |
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| Update Date | 2025-03-25 00:53:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201213 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H12N4O |
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| Molecular Mass | 216.1011 |
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| SMILES | COc1ccc(-c2cnc(N)nc2N)cc1 |
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| InChI Key | YAYRKDXDLKNBKG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenol ethers |
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| Subclass | anisoles |
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| Direct Parent | anisoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmethoxybenzenesorganopnictogen compoundsphenoxy compoundsprimary aminespyrimidines and pyrimidine derivatives |
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| Substituents | monocyclic benzene moietyetheraromatic heteromonocyclic compoundazacycleheteroaromatic compoundalkyl aryl ethermethoxybenzenepyrimidineorganic oxygen compoundanisoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundphenoxy compoundimidolactamamineorganoheterocyclic compoundorganooxygen compound |
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