| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:25 UTC |
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| Update Date | 2025-03-25 00:49:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177195 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H18O5 |
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| Molecular Mass | 254.1154 |
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| SMILES | Cc1ccc(C2OC(O)(CO)C(O)C2O)cc1C |
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| InChI Key | HLEZPENBKAZNJJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | xylenes |
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| Direct Parent | o-xylenes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | hemiacetalshydrocarbon derivativesmonosaccharidesoxacyclic compoundssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholaromatic heteromonocyclic compoundtetrahydrofuranmonosaccharideoxacyclesaccharideo-xyleneorganic oxygen compoundsecondary alcoholhemiacetalhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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