| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:28:24 UTC |
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| Update Date | 2025-03-21 18:40:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00130395 |
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| Frequency | 19.5 |
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| Structure | |
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| Chemical Formula | C8H14O7 |
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| Molecular Mass | 222.074 |
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| SMILES | OCC1OC2(CO)C(O)C(O)OC2C1O |
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| InChI Key | IQGMRIFDTPGKRX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | furofurans |
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| Subclass | isosorbides |
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| Direct Parent | isosorbides |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | dialkyl ethershemiacetalshydrocarbon derivativesmonosaccharidesoxacyclic compoundsprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholetherisosorbidetetrahydrofuranmonosaccharidedialkyl etheraliphatic heteropolycyclic compoundoxacyclesaccharideorganic oxygen compoundsecondary alcoholhemiacetalhydrocarbon derivativeprimary alcoholorganooxygen compound |
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