| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:02:48 UTC |
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| Update Date | 2025-03-25 00:54:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02207628 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H20O4 |
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| Molecular Mass | 264.1362 |
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| SMILES | O=C(CCC(O)Cc1ccccc1)OC1CCOC1 |
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| InChI Key | PDAGZXFBZBVNIJ-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 acid esters |
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| Direct Parent | fatty acid esters |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | benzene and substituted derivativescarbonyl compoundscarboxylic acid estersdialkyl ethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholmonocyclic benzene moietycarbonyl groupetheraromatic heteromonocyclic compoundtetrahydrofurancarboxylic acid derivativedialkyl etheroxacyclefatty acid esterorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativebenzenoidorganoheterocyclic compoundorganooxygen compound |
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