| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:46:36 UTC |
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| Update Date | 2025-03-25 01:10:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02307868 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C36H62O31 |
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| Molecular Mass | 990.3275 |
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| SMILES | CC1OC(OC2(OC3OC(CO)C(O)C(O)C3O)C(CO)OC(OC3C(O)C(COC4OC(CO)C(O)C(O)C4O)OC(OC4C(CO)OC(O)C(O)C4O)C3O)OC2CO)C(O)C(O)C1O |
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| InChI Key | KNFUGTSCEPHBLK-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-dioxaneshemiacetalshydrocarbon derivativesketalsmonosaccharidesortho estersoxacyclic compoundsoxanesprimary alcoholssecondary alcohols |
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| Substituents | alcoholortho estermonosaccharidecarboxylic acid orthoesteroxacyclesaccharideorganic oxygen compoundacetalketalaliphatic heteromonocyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeoxaneprimary alcoholmeta-dioxaneorganoheterocyclic compoundorganooxygen compound |
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