| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:57:56 UTC |
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| Update Date | 2025-03-21 18:05:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00057257 |
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| Frequency | 55.4 |
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| Structure | |
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| Chemical Formula | C9H9NO3S |
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| Molecular Mass | 211.0303 |
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| SMILES | CS(=O)(=O)Oc1c[nH]c2ccccc12 |
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| InChI Key | SHNRSOMJFWDDSN-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 | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesmethanesulfonatesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfonic acid esterspyrrolessulfonic acid esterssulfonyls |
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| Substituents | organosulfonic acid or derivativesazacycleindoleheteroaromatic compoundorganosulfur compoundorganosulfonic acid estersulfonic acid estermethanesulfonateorganic oxidesulfonylorganic oxygen compoundaromatic heteropolycyclic compoundorganic sulfonic acid or derivativespyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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