| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:53 UTC |
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| Update Date | 2025-03-25 00:50:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182823 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H8O5S |
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| Molecular Mass | 276.0092 |
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| SMILES | O=c1c(O)c(-c2ccsc2)oc2cc(O)cc(O)c12 |
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| InChI Key | XNOMUUODURJKJX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | benzopyrans |
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| Subclass | 1-benzopyrans |
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| Direct Parent | chromones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzenoidsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsoxacyclic compoundspyranones and derivativesthiophenesvinylogous acids |
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| Substituents | heteroaromatic compound1-hydroxy-2-unsubstituted benzenoidthiophene1-hydroxy-4-unsubstituted benzenoidoxacyclevinylogous acidorganic oxideorganic oxygen compoundchromonearomatic heteropolycyclic compoundpyranpyranonehydrocarbon derivativebenzenoidorganooxygen compound |
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