| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:58 UTC |
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| Update Date | 2025-03-25 00:50:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02180714 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H18O6 |
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| Molecular Mass | 330.1103 |
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| SMILES | Cc1c(CC(=O)O)c(CCC(=O)O)c(CC(=O)O)c2ccccc12 |
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| InChI Key | CFYPXCAQDITKQE-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 | naphthalenes |
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| Subclass | naphthalenes |
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| Direct Parent | naphthalenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesorganic oxidestricarboxylic acids and derivatives |
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| Substituents | carbonyl grouporganic oxidenaphthalenecarboxylic acidorganic oxygen compoundaromatic homopolycyclic compoundhydrocarbon derivativetricarboxylic acid or derivativescarboxylic acid derivativeorganooxygen compound |
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