Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:24:31 UTC |
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Update Date | 2025-03-21 18:38:31 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00121217 |
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Frequency | 21.4 |
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Structure | |
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Chemical Formula | C29H48O8 |
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Molecular Mass | 524.3349 |
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SMILES | CC1(C)C(O)CCC2(C)C1CCC1(C)C2CCC2CC(OC3OC(C(=O)O)C(O)C(O)C3O)CCC21C |
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InChI Key | PKZYKQVOTIDMLA-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | carbohydrates and carbohydrate conjugates |
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Direct Parent | monosaccharides |
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Geometric Descriptor | aliphatic heteropolycyclic compounds |
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Alternative Parents | acetalsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidscyclic alcohols and derivativesditerpene glycosidesditerpenoidsglucuronic acid derivativeshydrocarbon derivativesmonocarboxylic acids and derivativeso-glucuronidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcohols |
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Substituents | carbonyl groupcarboxylic acidglucuronic acid or derivativesabietane diterpenoido-glucuronidemonosaccharidecarboxylic acid derivativepyran carboxylic acidditerpene glycoside1-o-glucuronidealiphatic heteropolycyclic compoundbeta-hydroxy acidorganic oxideacetaloxaneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativesterpene glycosidehydroxy acidcyclic alcoholoxacyclemonocarboxylic acid or derivativespyransecondary alcoholhydrocarbon derivativediterpenoid |
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