| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:48 UTC |
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| Update Date | 2025-03-25 00:56:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02219401 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H18N4O3 |
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| Molecular Mass | 302.1379 |
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| SMILES | COc1cc(CC2CNc3nc(N)[nH]c(=O)c3C2)ccc1O |
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| InChI Key | PKXRHSFGQSRFEH-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 | pyridopyrimidines |
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| Subclass | pyridopyrimidines |
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| Direct Parent | pyridopyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamslactamsmethoxybenzenesmethoxyphenolsorganic oxidesorganopnictogen compoundsphenoxy compoundsprimary aminespyridines and derivativespyrimidonessecondary alkylarylaminesvinylogous amides |
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| Substituents | phenol ethermonocyclic benzene moietyetherlactam1-hydroxy-2-unsubstituted benzenoidmethoxyphenolpyrimidonealkyl aryl etherpyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundpyridopyrimidineorganopnictogen compoundimidolactamvinylogous amideazacycleheteroaromatic compoundsecondary aminemethoxybenzenesecondary aliphatic/aromatic aminepyridineorganic oxygen compoundanisolephenolhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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