Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:37:09 UTC |
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Update Date | 2025-03-25 00:45:26 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02149129 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C10H10O6 |
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Molecular Mass | 226.0477 |
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SMILES | O=C1OC(C(O)CO)c2cc(O)cc(O)c21 |
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InChI Key | QUMMXIFJOCGNBI-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 | benzofurans |
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Subclass | benzofuranones |
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Direct Parent | benzofuranones |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | 1,2-diols1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzenoidscarboxylic acid estershydrocarbon derivativeslactonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsphthalidesprimary alcoholssecondary alcoholsvinylogous acids |
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Substituents | benzofuranone1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativephthalidelactoneorganic oxideisobenzofuranoneisocoumaranaromatic heteropolycyclic compoundprimary alcohol1,2-diolalcohol1-hydroxy-4-unsubstituted benzenoidoxacyclevinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativebenzenoidorganooxygen compound |
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