| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:55 UTC |
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| Update Date | 2025-03-25 00:56:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02217338 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H17ClO5 |
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| Molecular Mass | 324.0765 |
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| SMILES | OC1C(CCl)OC(Oc2ccc3ccccc3c2)C(O)C1O |
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| InChI Key | LJNXLRRNNWJDPN-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 | naphthalenes |
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| Subclass | naphthalenes |
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| Direct Parent | naphthalenes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | acetalsalkyl chlorideshydrocarbon derivativesmonosaccharidesorganochloridesoxacyclic compoundsoxanesphenol etherssecondary alcohols |
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| Substituents | alcoholphenol etheralkyl chlorideorganochloridemonosaccharideorganohalogen compoundoxacyclesaccharidenaphthaleneorganic oxygen compoundacetalaromatic heteropolycyclic compoundsecondary alcoholalkyl halidehydrocarbon derivativeoxaneorganoheterocyclic compoundorganooxygen compound |
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