| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:24:26 UTC |
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| Update Date | 2025-03-21 18:38:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00120992 |
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| Frequency | 21.5 |
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| Structure | |
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| Chemical Formula | C17H30O16 |
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| Molecular Mass | 490.1534 |
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| SMILES | OCC1OC(CO)(OCC2(OC3OC(CO)C(O)C(O)C3O)OC(CO)C(O)C2O)OC1O |
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| InChI Key | WQTQITXYEGSXGC-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 | orthocarboxylic acid derivatives |
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| Subclass | carboxylic acid orthoesters |
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| Direct Parent | carboxylic acid orthoesters |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,3-dioxolaneshemiacetalshydrocarbon derivativesketalsmonosaccharidesortho estersoxacyclic compoundsoxanesprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholmeta-dioxolaneortho estertetrahydrofuranmonosaccharidecarboxylic acid orthoesteroxacyclesaccharideorganic oxygen compoundacetalketalaliphatic heteromonocyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeoxaneprimary alcoholorganoheterocyclic compoundorganooxygen compound |
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