| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:57:48 UTC |
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| Update Date | 2025-03-21 18:05:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00056952 |
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| Frequency | 55.8 |
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| Structure | |
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| Chemical Formula | C12H18O3 |
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| Molecular Mass | 210.1256 |
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| SMILES | CC(CO)Cc1ccc(C(O)CO)cc1 |
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| InChI Key | HZEXZLVITKSLGL-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 derivativesprimary alcoholssecondary alcohols |
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| Substituents | aromatic alcoholphenylpropanealcoholaromatic homomonocyclic compoundorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary alcoholorganooxygen compound |
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