| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:06 UTC |
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| Update Date | 2025-03-25 01:01:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02247385 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H18O5 |
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| Molecular Mass | 326.1154 |
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| SMILES | O=C(O)CCC1c2ccccc2C(c2ccc(O)cc2)C1C(=O)O |
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| InChI Key | GPKMXYBZZXFYHS-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 | indanes |
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| Direct Parent | indanes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsbenzene and substituted derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxides |
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| Substituents | monocyclic benzene moietycarbonyl groupcarboxylic acid1-hydroxy-2-unsubstituted benzenoidaromatic homopolycyclic compoundcarboxylic acid derivativeorganic oxideorganic oxygen compoundindanedicarboxylic acid or derivativesphenolhydrocarbon derivativeorganooxygen compound |
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