| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:34:41 UTC |
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| Update Date | 2025-03-21 17:56:42 UTC |
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| HMDB ID | HMDB0029758 |
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| Metabolite Identification |
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| DeepMet ID | DMID00003059 |
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| Name | Herniarin |
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| Frequency | 1934.2 |
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| Structure | |
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| Chemical Formula | C10H8O3 |
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| Molecular Mass | 176.0473 |
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| SMILES | COc1ccc2ccc(=O)oc2c1 |
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| InChI Key | LIIALPBMIOVAHH-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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