| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:37:31 UTC |
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| Update Date | 2025-03-21 17:57:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00009679 |
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| Frequency | 494.9 |
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| Structure | |
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| Chemical Formula | C8H12O7 |
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| Molecular Mass | 220.0583 |
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| SMILES | COC1=C(O)C(C(O)C(O)CO)OC1=O |
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| InChI Key | VOCSNYUOTCVFNS-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 | dihydrofurans |
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| Subclass | furanones |
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| Direct Parent | butenolides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundsdihydrofuransenoate estershydrocarbon derivativeslactonesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsprimary alcoholssecondary alcoholsvinylogous acids |
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| Substituents | enoate esteralcoholcarbonyl groupmonosaccharidecarboxylic acid derivativelactoneoxacyclealpha,beta-unsaturated carboxylic estervinylogous acid2-furanonesaccharideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeprimary alcoholorganooxygen compound |
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