| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:09:48 UTC |
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| Update Date | 2025-03-24 19:55:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01080720 |
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| Frequency | 1.3 |
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| Structure | |
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| Chemical Formula | C6H8O3 |
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| Molecular Mass | 128.0473 |
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| SMILES | OC1C2COC1C1OC21 |
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| InChI Key | YUNWLFJBXNSSSU-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 | dioxepanes |
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| Subclass | 1,4-dioxepanes |
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| Direct Parent | 1,4-dioxepanes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | cyclic alcohols and derivativesdialkyl ethersepoxideshydrocarbon derivativesmonosaccharidesoxacyclic compoundsoxanessecondary alcoholstetrahydrofurans |
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| Substituents | alcoholethertetrahydrofuran1,4-dioxepaneoxiranemonosaccharidecyclic alcoholdialkyl etheraliphatic heteropolycyclic compoundoxacyclesaccharideorganic oxygen compoundsecondary alcoholhydrocarbon derivativeoxaneorganooxygen compound |
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