| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:38 UTC |
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| Update Date | 2025-03-25 00:54:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02204980 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H12O4S |
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| Molecular Mass | 204.0456 |
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| SMILES | O=S(=O)(O)CCCCc1ccco1 |
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| InChI Key | BWKZFZWLPOTPFG-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 | furans |
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| Subclass | furans |
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| Direct Parent | furans |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | heteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganosulfonic acidsoxacyclic compoundssulfonyls |
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| Substituents | furanorganosulfonic acid or derivativesaromatic heteromonocyclic compoundheteroaromatic compoundorganosulfonic acidorganosulfur compoundoxacycleorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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