| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:14:16 UTC |
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| Update Date | 2025-03-21 18:33:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00096240 |
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| Frequency | 28.7 |
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| Structure | |
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| Chemical Formula | C10H8O4 |
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| Molecular Mass | 192.0423 |
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| SMILES | O=C1CC(O)(C(=O)O)c2ccccc21 |
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| InChI Key | ACQDJSPKPIYUDP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | indanes |
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| Subclass | indanones |
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| Direct Parent | indanones |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativesaryl alkyl ketonescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidestertiary alcohols |
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| Substituents | alcoholcarbonyl groupcarboxylic acidaryl alkyl ketonealpha-hydroxy acidindanonearomatic homopolycyclic compoundhydroxy acidcarboxylic acid derivativeketonetertiary alcoholorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compoundaryl ketone |
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