| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:27:14 UTC |
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| Update Date | 2025-03-21 18:39:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00127597 |
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| Frequency | 20.0 |
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| Structure | |
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| Chemical Formula | C8H8N2O2 |
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| Molecular Mass | 164.0586 |
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| SMILES | COc1ccc2[nH][nH]c(=O)c2c1 |
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| InChI Key | JVIODNHCPBUTPK-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 | benzopyrazoles |
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| Subclass | indazoles |
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| Direct Parent | indazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrazolespyrazolonesvinylogous amides |
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| Substituents | vinylogous amidephenol etheretherlactamazacycleindazoleheteroaromatic compoundalkyl aryl etherpyrazoleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundanisoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundbenzopyrazoleorganooxygen compoundazolepyrazolinone |
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