| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:59 UTC |
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| Update Date | 2025-03-25 00:59:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02240075 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H8N2O2 |
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| Molecular Mass | 188.0586 |
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| SMILES | O=C1CCc2cc3[nH]c(=O)[nH]c3cc21 |
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| InChI Key | GVPPZWPKNVKLHE-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 | indanes |
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| Subclass | indanones |
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| Direct Parent | indanones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl alkyl ketonesazacyclic compoundsbenzimidazolesheteroaromatic compoundshydrocarbon derivativesimidazolesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | carbonic acid derivativearyl alkyl ketoneazacycleheteroaromatic compoundindanoneketoneorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundbenzimidazoleimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundaryl ketoneazole |
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