| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:38 UTC |
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| Update Date | 2025-03-25 00:47:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161580 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H24N4O2 |
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| Molecular Mass | 364.1899 |
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| SMILES | C=CC1CN2CCC1CC2C(O)c1ccnc2nc3cc(OC)ccc3n12 |
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| InChI Key | AOPFVJOCRDNDIP-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 | benzimidazoles |
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| Subclass | benzimidazoles |
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| Direct Parent | benzimidazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsalkyl aryl ethersanisolesaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazo[1,2-a]pyrimidinesimidazolesn-substituted imidazolesorganopnictogen compoundspiperidinespyrimidines and pyrimidine derivativesquinuclidinessecondary alcoholstrialkylamines |
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| Substituents | aromatic alcoholphenol etheretherimidazo[1,2-a]pyrimidinequinuclidinealkyl aryl etherpyrimidinearomatic heteropolycyclic compoundbenzimidazoleimidazoleorganonitrogen compoundorganopnictogen compoundpiperidinetertiary amineazolen-substituted imidazolealcoholazacycle1,2-aminoalcoholheteroaromatic compoundtertiary aliphatic amineorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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