| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:58 UTC |
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| Update Date | 2025-03-25 00:46:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153416 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H16O4 |
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| Molecular Mass | 284.1049 |
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| SMILES | COc1ccc2c(c1OC)CC(c1ccc(O)cc1)C2=O |
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| InChI Key | OOAHLMFELVNEEB-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 | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesaryl alkyl ketonesbenzene and substituted derivativeshydrocarbon derivativesorganic oxides |
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| Substituents | phenol ethermonocyclic benzene moietyetheraryl alkyl ketoneindanone1-hydroxy-2-unsubstituted benzenoidaromatic homopolycyclic compoundalkyl aryl etherketoneorganic oxideorganic oxygen compoundanisolephenolhydrocarbon derivativeorganooxygen compoundaryl ketone |
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