| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:17:27 UTC |
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| Update Date | 2025-03-21 20:52:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00384036 |
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| Frequency | 4.8 |
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| Structure | |
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| Chemical Formula | C8H8O2 |
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| Molecular Mass | 136.0524 |
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| SMILES | Cc1cc2c(o1)CCC2=O |
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| InChI Key | ITQXPHKVQQLUQK-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 | furans |
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| Subclass | furoic acid and derivatives |
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| Direct Parent | furoic acid and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl alkyl ketonesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsoxacyclic compounds |
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| Substituents | furoic acid or derivativesaryl alkyl ketoneheteroaromatic compoundketoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundhydrocarbon derivativeorganooxygen compoundaryl ketone |
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