| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:39:11 UTC |
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| Update Date | 2025-03-25 01:08:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02290764 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H12O2 |
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| Molecular Mass | 128.0837 |
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| SMILES | C=C(CCC)C(=O)CO |
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| InChI Key | IVWYDXMELUIJGH-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 | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsalcohols and polyolsalpha-branched alpha,beta-unsaturated ketonesalpha-hydroxy ketonesenoneshydrocarbon derivativesmonosaccharidesorganic oxides |
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| Substituents | alcoholalpha-branched alpha,beta-unsaturated-ketonealiphatic acyclic compoundcarbonyl groupmonosaccharidealpha,beta-unsaturated ketonealpha-hydroxy ketoneketonesaccharideorganic oxideorganic oxygen compoundfatty alcoholhydrocarbon derivativeacryloyl-grouporganooxygen compoundenone |
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