| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:11:13 UTC |
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| Update Date | 2025-03-25 00:57:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02227098 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H17N5O |
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| Molecular Mass | 283.1433 |
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| SMILES | CC(C)c1ccccc1C1=Nc2c([nH]c(N)nc2=O)NC1 |
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| InChI Key | DUTMWQVBUOHWHS-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 | azacyclic compoundscumenesheteroaromatic compoundshydrocarbon derivativesketiminesorganic oxidesorganooxygen compoundsorganopnictogen compoundsphenylpropanesprimary aminespropargyl-type 1,3-dipolar organic compoundspyrimidonessecondary alkylarylaminesvinylogous amides |
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| Substituents | ketiminemonocyclic benzene moietyiminepyrimidonepyrimidinepropargyl-type 1,3-dipolar organic compoundphenylpropaneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundcumenevinylogous amidepterinazacycleheteroaromatic compoundorganic 1,3-dipolar compoundsecondary aminesecondary aliphatic/aromatic amineorganic oxygen compoundhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundamineorganooxygen compound |
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