| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:40 UTC |
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| Update Date | 2025-03-21 18:37:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00114396 |
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| Frequency | 23.1 |
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| Structure | |
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| Chemical Formula | C13H20O2 |
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| Molecular Mass | 208.1463 |
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| SMILES | CC(O)Cc1ccc(C(O)C(C)C)cc1 |
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| InChI Key | GEMYLPCJJWEARS-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 | phenylpropanes |
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| Direct Parent | phenylpropanes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aromatic alcoholshydrocarbon derivativessecondary alcohols |
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| Substituents | aromatic alcoholphenylpropanealcoholaromatic homomonocyclic compoundorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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