| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:09 UTC |
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| Update Date | 2025-03-25 00:56:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02215550 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H12N2O2S |
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| Molecular Mass | 212.0619 |
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| SMILES | CC1NCc2cc(S(N)(=O)=O)ccc21 |
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| InChI Key | VSTWVSWRYQGTTB-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 | isoindoles and derivatives |
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| Subclass | isoindoles |
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| Direct Parent | isoindoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aminosulfonyl compoundsazacyclic compoundsbenzenoidsdialkylamineshydrocarbon derivativesisoindolinesorganic oxidesorganopnictogen compoundsorganosulfonamides |
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| Substituents | secondary aliphatic amineorganosulfonic acid or derivativesazacycleaminosulfonyl compoundisoindolesecondary amineorganosulfur compoundorganosulfonic acid amideorganic oxidesulfonylorganic oxygen compoundisoindolinearomatic heteropolycyclic compoundorganic sulfonic acid or derivativesorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundamine |
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