Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:48:38 UTC |
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Update Date | 2025-03-25 00:49:36 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02175361 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C14H8O6 |
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Molecular Mass | 272.0321 |
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SMILES | COc1cc2c(c3oc(=O)c4oc(=O)ccc4c13)CO2 |
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InChI Key | YZHCIWCOHGXNSY-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | phenylpropanoids and polyketides |
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Class | coumarins and derivatives |
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Subclass | coumarins and derivatives |
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Direct Parent | coumarins and derivatives |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | 1-benzopyransalkyl aryl ethersanisolesheteroaromatic compoundshydrocarbon derivativeslactonesorganic oxidesoxacyclic compoundspyranones and derivatives |
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Substituents | phenol etheretherbenzopyran1-benzopyranheteroaromatic compoundalkyl aryl ethercoumarinlactoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrananisolepyranonehydrocarbon derivativebenzenoidorganoheterocyclic compoundorganooxygen compound |
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