Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:28:17 UTC |
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Update Date | 2025-03-21 18:40:25 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00130119 |
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Frequency | 19.5 |
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Structure | |
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Chemical Formula | C7H12O6 |
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Molecular Mass | 192.0634 |
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SMILES | CCOC1OC(=O)C(O)C(O)C1O |
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InChI Key | GQKJAPLGGBHZEL-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organoheterocyclic compounds |
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Class | lactones |
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Subclass | delta valerolactones |
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Direct Parent | delta valerolactones |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | acetalscarbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanessecondary alcohols |
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Substituents | alcoholcarbonyl groupdelta valerolactonemonosaccharidecarboxylic acid derivativeoxacyclesaccharideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundacetalcarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeoxanedelta_valerolactoneorganooxygen compound |
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