| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:24 UTC |
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| Update Date | 2025-03-25 00:58:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02234203 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H13NO2 |
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| Molecular Mass | 167.0946 |
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| SMILES | Cc1c(O)ccc(CO)c1CN |
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| InChI Key | FJWSMPNTEHMMNJ-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 | cresols |
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| Direct Parent | ortho cresols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaromatic alcoholsbenzyl alcoholshydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundstoluenes |
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| Substituents | aromatic alcoholalcoholmonocyclic benzene moiety1-hydroxy-2-unsubstituted benzenoidbenzyl alcoholaromatic homomonocyclic compoundorganic oxygen compoundo-cresolorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundtolueneorganooxygen compound |
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