| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:05 UTC |
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| Update Date | 2025-03-21 18:37:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00115401 |
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| Frequency | 22.8 |
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| Structure | |
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| Chemical Formula | C12H18O5 |
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| Molecular Mass | 242.1154 |
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| SMILES | OCC(O)C(O)C(CO)Cc1cccc(O)c1 |
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| InChI Key | NJTMIKZJKYMHJQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty alcohols |
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| Direct Parent | fatty alcohols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativeshydrocarbon derivativesprimary alcoholssecondary alcohols |
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| Substituents | alcoholmonocyclic benzene moiety1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundorganic oxygen compoundfatty alcoholsecondary alcoholphenolhydrocarbon derivativebenzenoidprimary alcoholorganooxygen compound |
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