| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:44:53 UTC |
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| Update Date | 2025-03-21 18:00:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00026376 |
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| Frequency | 145.2 |
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| Structure | |
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| Chemical Formula | C8H12N2O |
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| Molecular Mass | 152.095 |
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| SMILES | NCCc1ccc(O)c(N)c1 |
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| InChI Key | TXORYVHZKLWJBK-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 | phenols |
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| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
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| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | benzene and substituted derivativeshydrocarbon derivativesmonoalkylaminesorganooxygen compoundsorganopnictogen compounds |
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| Substituents | monocyclic benzene moiety1-hydroxy-2-unsubstituted benzenoidaromatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineprimary amineorganic nitrogen compoundamineorganooxygen compound |
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