| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:06 UTC |
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| Update Date | 2025-03-25 01:00:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02245012 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H22O6 |
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| Molecular Mass | 298.1416 |
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| SMILES | CCc1c(C2OC(CO)C(O)C(O)C2O)ccc(C)c1O |
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| InChI Key | TYJAQDVNCSRSHC-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 | phenols |
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| Subclass | cresols |
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| Direct Parent | ortho cresols |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-4-unsubstituted benzenoidsdialkyl ethershydrocarbon derivativesmonosaccharidesoxacyclic compoundsoxanesprimary alcoholssecondary alcoholstoluenes |
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| Substituents | alcoholmonocyclic benzene moietyetheraromatic heteromonocyclic compoundmonosaccharide1-hydroxy-4-unsubstituted benzenoiddialkyl etheroxacyclesaccharideorganic oxygen compoundo-cresolsecondary alcoholhydrocarbon derivativeoxaneprimary alcoholtolueneorganoheterocyclic compoundorganooxygen compound |
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