| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:16 UTC |
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| Update Date | 2025-03-25 00:54:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02204152 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H13N3O2 |
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| Molecular Mass | 243.1008 |
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| SMILES | Oc1ccc2[nH]cc(C(O)Cn3ccnc3)c2c1 |
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| InChI Key | NLLLGPJKQNBUHK-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 | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaromatic alcoholsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesimidazolesn-substituted imidazolesorganonitrogen compoundsorganopnictogen compoundspyrrolessecondary alcohols |
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| Substituents | aromatic alcoholalcoholazacycleindoleheteroaromatic compound1-hydroxy-2-unsubstituted benzenoidorganic oxygen compoundaromatic heteropolycyclic compoundimidazolepyrroleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundazolen-substituted imidazole |
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