| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:57:39 UTC |
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| Update Date | 2025-03-25 00:52:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02195810 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C25H38O9 |
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| Molecular Mass | 482.2516 |
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| SMILES | CC12CC(O)C3C(CCC4OC(C(=O)O)C(O)C(O)C(O)C5CC(CCC43C)O5)C1CCC2=O |
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| InChI Key | MLQYLLJKWJEVNF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | hydroxy acids and derivatives |
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| Subclass | beta hydroxy acids and derivatives |
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| Direct Parent | beta hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | carboxylic acidscyclic alcohols and derivativesdialkyl ethershydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxetanessecondary alcohols |
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| Substituents | alcoholcarbonyl groupethercarboxylic acidcyclic alcoholcarboxylic acid derivativedialkyl etherketonealiphatic heteropolycyclic compoundoxacyclebeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundoxetanesecondary alcoholhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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