| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:23 UTC |
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| Update Date | 2025-03-25 00:59:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02238709 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H10O4 |
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| Molecular Mass | 206.0579 |
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| SMILES | O=C(O)COc1ccc2c(c1)CCC2=O |
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| InChI Key | OGBQAOUURGRJJI-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 | alkyl aryl ethersaryl alkyl ketonescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesphenol ethersphenoxyacetic acid derivatives |
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| Substituents | phenol etherphenoxyacetatecarbonyl groupethercarboxylic acidaryl alkyl ketoneindanonearomatic homopolycyclic compoundalkyl aryl ethercarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compoundaryl ketone |
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