| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:41 UTC |
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| Update Date | 2025-03-25 00:47:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159492 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H10O5 |
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| Molecular Mass | 174.0528 |
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| SMILES | O=CC(O)C(O)C1CCOC1=O |
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| InChI Key | ZQJVBBKCGBAMDB-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 | gamma butyrolactones |
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| Direct Parent | gamma butyrolactones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolsalpha-hydroxyaldehydesbeta-hydroxy aldehydescarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholbeta-hydroxy aldehydecarbonyl grouptetrahydrofuranmonosaccharidealdehydecarboxylic acid derivativegamma butyrolactoneoxacyclesaccharideorganic oxidemonocarboxylic acid or derivativesalpha-hydroxyaldehydeorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound1,2-diol |
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