| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:14:59 UTC |
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| Update Date | 2025-03-21 18:33:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00098042 |
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| Frequency | 28.1 |
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| Structure | |
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| Chemical Formula | C16H28O15 |
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| Molecular Mass | 460.1428 |
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| SMILES | OCC1OC(OC2(OC3OC(CO)C(O)C(O)C3O)OC(CO)C2O)C(O)C(O)C1O |
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| InChI Key | KEGCXOCLSYLNOS-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 | acetalshydrocarbon derivativesmonosaccharidesortho estersoxacyclic compoundsoxanesoxetanesprimary alcoholssecondary alcohols |
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| Substituents | alcoholortho estermonosaccharidecarboxylic acid orthoesteroxacyclesaccharideorganic oxygen compoundacetaloxetanealiphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeoxaneprimary alcoholorganoheterocyclic compoundorganooxygen compound |
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