| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:36 UTC |
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| Update Date | 2025-03-25 00:56:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02216596 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H10O4 |
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| Molecular Mass | 218.0579 |
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| SMILES | CCC1=C(O)C(=O)c2ccc(O)cc2C1=O |
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| InChI Key | JSGDBVXSQDETEY-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 | naphthoquinones |
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| Direct Parent | naphthoquinones |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaryl ketoneshydrocarbon derivativesorganic oxidesorganooxygen compoundsquinonesvinylogous acids |
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| Substituents | 1-hydroxy-2-unsubstituted benzenoidaromatic homopolycyclic compoundketonevinylogous acidorganic oxideorganic oxygen compoundhydrocarbon derivativenaphthoquinoneorganooxygen compoundaryl ketonequinone |
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