| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:27 UTC |
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| Update Date | 2025-03-25 00:50:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02179550 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H10O3 |
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| Molecular Mass | 250.063 |
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| SMILES | COc1ccc2cccc3ccc4c-3c2c1oc4=O |
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| InChI Key | JQQQZKQXQQRXRA-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 | cycloheptapyrans |
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| Subclass | cycloheptapyrans |
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| Direct Parent | cycloheptapyrans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyransalkyl aryl ethersanisolesazulenescoumarins and derivativesheteroaromatic compoundshydrocarbon derivativeslactonesorganic oxidesoxacyclic compoundspyranones and derivatives |
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| Substituents | phenol etheretherbenzopyranazulene1-benzopyranheteroaromatic compoundalkyl aryl ethercycloheptapyrancoumarinlactoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrananisolepyranonehydrocarbon derivativebenzenoidorganooxygen compound |
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