| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:38:58 UTC |
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| Update Date | 2025-03-21 17:58:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00013119 |
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| Frequency | 343.1 |
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| Structure | |
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| Chemical Formula | C9H7O5+ |
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| Molecular Mass | 195.0288 |
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| SMILES | Oc1cc(O)c2c(O)cc(O)[o+]c2c1 |
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| InChI Key | NQBGQUIDBVCCFA-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | coumarins and derivatives |
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| Subclass | coumarins and derivatives |
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| Direct Parent | coumarins and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyrans1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzenoidsheteroaromatic compoundshydrocarbon derivativesorganic cationsorganooxygen compoundsoxacyclic compounds |
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| Substituents | benzopyran1-benzopyranheteroaromatic compound1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidcoumarinoxacycleorganic oxygen compoundaromatic heteropolycyclic compoundhydrocarbon derivativebenzenoidorganic cationorganoheterocyclic compoundorganooxygen compound |
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