| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:09:41 UTC |
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| Update Date | 2025-03-21 18:31:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00085386 |
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| Frequency | 33.5 |
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| Structure | |
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| Chemical Formula | C12H22O11 |
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| Molecular Mass | 342.1162 |
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| SMILES | OCC1OC(OC2(CO)OC(CO)C(O)C2O)OC(CO)C1O |
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| InChI Key | WTJBKFWUEOKPSE-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-dioxaneshydrocarbon derivativesketalsmonosaccharidesortho estersoxacyclic compoundsprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholortho estertetrahydrofuranmonosaccharidecarboxylic acid orthoesteroxacyclesaccharideorganic oxygen compoundacetalketalaliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeprimary alcoholmeta-dioxaneorganoheterocyclic compoundorganooxygen compound |
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