| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:02 UTC |
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| Update Date | 2025-03-25 00:58:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02233357 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H5IO2 |
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| Molecular Mass | 259.9334 |
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| SMILES | O=C1COc2ccc(I)cc21 |
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| InChI Key | JEHKHXISMMCMEU-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 | benzofurans |
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| Subclass | benzofuranones |
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| Direct Parent | benzofuranones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersaryl alkyl ketonesaryl iodidesbenzenoidscoumaranshydrocarbon derivativesorganic oxidesorganoiodidesoxacyclic compounds |
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| Substituents | etheraryl alkyl ketonebenzofuranonealkyl aryl etherorganohalogen compoundorganoiodidearyl halideketoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundhydrocarbon derivativebenzenoidaryl iodidecoumaranorganooxygen compoundaryl ketone |
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