| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:07 UTC |
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| Update Date | 2025-03-25 01:01:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02251957 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H11N3O2S |
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| Molecular Mass | 273.0572 |
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| SMILES | O=S(=O)(Nc1ccccn1)c1c[nH]c2ccccc12 |
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| InChI Key | VCSNWWOALBWKRX-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 | 2-halopyridinesaminosulfonyl compoundsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesimidolactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamidespyridines and derivativespyrroles |
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| Substituents | organosulfonic acid or derivativesazacycleaminosulfonyl compoundindoleheteroaromatic compoundorganosulfur compoundorganosulfonic acid amideorganic oxidesulfonylpyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganic sulfonic acid or derivativespyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundimidolactam |
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