| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:57 UTC |
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| Update Date | 2025-03-25 00:50:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182955 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H4Cl2O2 |
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| Molecular Mass | 213.9588 |
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| SMILES | O=c1ccc2ccc(Cl)c(Cl)c2o1 |
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| InChI Key | YNJCEECEEKGTNJ-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-benzopyransaryl chloridesbenzenoidsheteroaromatic compoundshydrocarbon derivativeslactonesorganic oxidesorganochloridesorganooxygen compoundsoxacyclic compoundspyranones and derivatives |
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| Substituents | aryl chloridebenzopyran1-benzopyranorganochlorideheteroaromatic compoundorganohalogen compoundcoumarinaryl halidelactoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyranpyranonehydrocarbon derivativebenzenoidorganoheterocyclic compoundorganooxygen compound |
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