| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:41 UTC |
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| Update Date | 2025-03-25 00:59:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02239359 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H17NO3S2 |
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| Molecular Mass | 275.065 |
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| SMILES | O=S(=O)(O)CCNCCSCc1ccccc1 |
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| InChI Key | ZXAGWYHSYXMQQA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzene and substituted derivatives |
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| Direct Parent | benzene and substituted derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | dialkylaminesdialkylthioethershydrocarbon derivativesorganic oxidesorganopnictogen compoundsorganosulfonic acidssulfenyl compoundssulfonyls |
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| Substituents | secondary aliphatic amineorganosulfonic acid or derivativesmonocyclic benzene moietysulfenyl compounddialkylthioetherorganosulfonic acidsecondary amineorganosulfur compoundaromatic homomonocyclic compoundorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesthioetherorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundamine |
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