| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:27 UTC |
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| Update Date | 2025-03-25 00:51:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02186377 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H28O14 |
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| Molecular Mass | 444.1479 |
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| SMILES | OCC1OC(OC2C(CO)OC(O)C2O)OC1COC1OC(CO)C(O)C(O)C1O |
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| InChI Key | RQYCJTUDDBKBMX-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-dioxolanesacetalshemiacetalshydrocarbon derivativesmonosaccharidesortho estersoxacyclic compoundsoxanesprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholmeta-dioxolaneortho estertetrahydrofuranmonosaccharidecarboxylic acid orthoesteroxacyclesaccharideorganic oxygen compoundacetalaliphatic heteromonocyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeoxaneprimary alcoholorganoheterocyclic compoundorganooxygen compound |
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