| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:36 UTC |
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| Update Date | 2025-03-25 00:49:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177616 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H12S |
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| Molecular Mass | 176.066 |
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| SMILES | Cc1cc2csc(C)c2cc1C |
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| InChI Key | YPSZVBQJKUBSCG-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 | benzothiophenes |
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| Subclass | 2-benzothiophenes |
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| Direct Parent | 2-benzothiophenes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | benzenoidsheteroaromatic compoundshydrocarbon derivativesthiophenes |
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| Substituents | 2-benzothiophenearomatic heteropolycyclic compoundheteroaromatic compoundhydrocarbon derivativebenzenoidthiophene |
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