| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:34:21 UTC |
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| Update Date | 2025-03-21 22:50:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00566846 |
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| Frequency | 2.9 |
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| Structure | |
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| Chemical Formula | C7H10O3 |
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| Molecular Mass | 142.063 |
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| SMILES | CC=CC(=O)C(=O)C(C)O |
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| InChI Key | NYSRCLIJULHYIR-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 compoundsacyloinsalpha-diketonesalpha-hydroxy ketonesbeta-hydroxy ketonesenoneshydrocarbon derivativesorganic oxidessecondary alcohols |
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| Substituents | alcoholbeta-hydroxy ketonealiphatic acyclic compoundcarbonyl groupalpha,beta-unsaturated ketonealpha-hydroxy ketonealpha-diketoneketoneorganic oxideorganic oxygen compoundfatty alcoholacyloinsecondary alcoholhydrocarbon derivativeacryloyl-grouporganooxygen compoundenone |
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