| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:17 UTC |
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| Update Date | 2025-03-25 00:50:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183697 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H12O4 |
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| Molecular Mass | 268.0736 |
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| SMILES | O=C1c2c(ccc3c2OCO3)CC1c1ccc(O)cc1 |
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| InChI Key | OQDBDONZCAJUIW-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-hydroxy-2-unsubstituted benzenoidsacetalsaryl alkyl ketonesbenzene and substituted derivativesbenzodioxoleshydrocarbon derivativesorganic oxidesorganooxygen compoundsoxacyclic compounds |
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| Substituents | monocyclic benzene moietyaryl alkyl ketoneindanone1-hydroxy-2-unsubstituted benzenoidketoneoxacycleorganic oxideorganic oxygen compoundacetalaromatic heteropolycyclic compoundphenolhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compoundaryl ketonebenzodioxole |
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