| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:57 UTC |
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| Update Date | 2025-03-25 00:51:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02189804 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H22O4 |
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| Molecular Mass | 242.1518 |
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| SMILES | C=CCCCCCCCC(=O)CC(O)C(=O)O |
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| InChI Key | OASFJOMXEDTPPU-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 acids and conjugates |
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| Direct Parent | long-chain fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativesbeta-hydroxy ketonescarboxylic acidsfatty alcoholsgamma-keto acids and derivativeshydrocarbon derivativeshydroxy fatty acidsketo fatty acidsmonocarboxylic acids and derivativesorganic oxidessecondary alcohols |
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| Substituents | alcoholbeta-hydroxy ketonealiphatic acyclic compoundcarbonyl grouplong-chain fatty acidcarboxylic acidketo fatty acidalpha-hydroxy acidhydroxy acidcarboxylic acid derivativegamma-keto acidketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundfatty alcoholketo acidsecondary alcoholhydrocarbon derivativehydroxy fatty acidorganooxygen compound |
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