| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:54 UTC |
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| Update Date | 2025-03-25 01:00:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02242194 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H28O4 |
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| Molecular Mass | 272.1988 |
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| SMILES | CC(CCCC1(C)CCC(C)(C(C)(C)O)O1)C(=O)O |
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| InChI Key | XZPDYWOREYBOCO-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 | prenol lipids |
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| Subclass | sesquiterpenoids |
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| Direct Parent | sesquiterpenoids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdialkyl ethersheterocyclic fatty acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundstertiary alcoholstetrahydrofurans |
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| Substituents | fatty acylcarbonyl groupethercarboxylic acidheterocyclic fatty acidfatty acidcarboxylic acid derivativemedium-chain hydroxy aciddialkyl etherorganic oxidesesquiterpenoidaliphatic heteromonocyclic compoundmedium-chain fatty acidhydroxy fatty acidorganoheterocyclic compoundalcoholmethyl-branched fatty acidtetrahydrofuranbranched fatty acidoxacycletertiary alcoholmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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