Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:43:32 UTC |
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Update Date | 2025-03-25 00:47:43 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02163649 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C17H28O4 |
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Molecular Mass | 296.1988 |
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SMILES | CC12CC(O)CCC1CCC2CCC1CC(O)CC(=O)O1 |
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InChI Key | GKSLGNMAJMYKEB-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 heteropolycyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acid esterscyclic alcohols and derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxanessecondary alcohols |
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Substituents | alcoholcarbonyl groupdelta valerolactonecyclic alcoholcarboxylic acid derivativealiphatic heteropolycyclic compoundoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativeoxanedelta_valerolactoneorganooxygen compound |
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