| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:25 UTC |
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| Update Date | 2025-03-25 01:01:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02248056 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H20O10 |
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| Molecular Mass | 324.1056 |
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| SMILES | O=C1CC(O)C(OC2C(CO)OC(O)C(O)C2O)C(CO)O1 |
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| InChI Key | WJNFFXKRKZVQEE-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 | carbonyl compoundscarboxylic acid estersdialkyl ethershemiacetalshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanesprimary alcoholssecondary alcohols |
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| Substituents | alcoholcarbonyl groupetherdelta valerolactonemonosaccharidecarboxylic acid derivativedialkyl etheroxacyclesaccharideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeoxaneprimary alcoholdelta_valerolactoneorganooxygen compound |
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