| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:34 UTC |
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| Update Date | 2025-03-21 18:06:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00065864 |
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| Frequency | 46.4 |
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| Structure | |
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| Chemical Formula | C9H12O |
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| Molecular Mass | 136.0888 |
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| SMILES | Cc1ccc(CCO)cc1 |
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| InChI Key | DAVFJRVIVZOKKS-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 | benzene and substituted derivatives |
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| Subclass | toluenes |
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| Direct Parent | toluenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alcohols and polyolshydrocarbon derivatives |
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| Substituents | alcoholaromatic homomonocyclic compoundorganic oxygen compoundhydrocarbon derivativetolueneorganooxygen compound |
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