| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:38:51 UTC |
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| Update Date | 2025-03-24 14:00:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00719860 |
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| Frequency | 2.1 |
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| Structure | |
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| Chemical Formula | C6H6OS |
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| Molecular Mass | 126.0139 |
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| SMILES | Cc1cc(=O)ccs1 |
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| InChI Key | XQYMNLBIGUORFQ-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 | heteroaromatic compounds |
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| Subclass | heteroaromatic compounds |
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| Direct Parent | heteroaromatic compounds |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | cyclic ketoneshydrocarbon derivativesorganic oxidesorganooxygen compounds |
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| Substituents | organic oxideorganic oxygen compoundaromatic heteromonocyclic compoundheteroaromatic compoundhydrocarbon derivativecyclic ketoneorganooxygen compound |
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