| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:23:31 UTC |
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| Update Date | 2025-03-24 21:09:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01690790 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C7H12OS |
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| Molecular Mass | 144.0609 |
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| SMILES | C=CCS(=O)CC=CC |
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| InChI Key | QAEJKONYINVHQP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | sulfoxides |
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| Subclass | sulfoxides |
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| Direct Parent | sulfoxides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | allyl sulfur compoundshydrocarbon derivativesorganic oxidessulfinyl compounds |
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| Substituents | aliphatic acyclic compoundorganic oxideorganic oxygen compoundsulfinyl compoundallyl sulfur compoundsulfoxidehydrocarbon derivative |
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