| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:37 UTC |
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| Update Date | 2025-03-25 00:50:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02179890 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H20O4 |
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| Molecular Mass | 288.1362 |
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| SMILES | Cc1c2c(cc3c1CCC3=O)OC(C)(CCC(=O)O)CC2 |
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| InChI Key | OJPGVDHZCHXSFE-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 heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyransalkyl aryl ethersaryl alkyl ketonescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl groupetherbenzopyrancarboxylic acidaryl alkyl ketone1-benzopyranindanonealkyl aryl ethercarboxylic acid derivativeketoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundchromanehydrocarbon derivativeorganoheterocyclic compoundorganooxygen compoundaryl ketone |
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