| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:02:57 UTC |
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| Update Date | 2025-03-21 18:07:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00069217 |
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| Frequency | 43.7 |
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| Structure | |
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| Chemical Formula | C16H8O6 |
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| Molecular Mass | 296.0321 |
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| SMILES | O=c1oc2cc(O)ccc2c2oc3cc(O)ccc3c2c1=O |
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| InChI Key | JTHJAETWZKQFOB-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 | benzoxepines |
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| Subclass | benzoxepines |
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| Direct Parent | benzoxepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsbenzenoidsbenzofuransfuransheteroaromatic compoundshydrocarbon derivativeslactonesorganic oxidesorganooxygen compoundsoxacyclic compounds |
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| Substituents | furanbenzofuranbenzoxepineheteroaromatic compound1-hydroxy-2-unsubstituted benzenoidlactoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundhydrocarbon derivativebenzenoidorganooxygen compound |
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