| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:48 UTC |
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| Update Date | 2025-03-25 00:48:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02166620 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H27N3O4S |
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| Molecular Mass | 309.1722 |
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| SMILES | CC(=O)NCCCNCCCCCNCCS(=O)(=O)O |
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| InChI Key | RQUSTGRQMBUYDP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | organic sulfonic acids and derivatives |
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| Subclass | organosulfonic acids and derivatives |
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| Direct Parent | organosulfonic acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetamidesamino acids and derivativescarbonyl compoundscarboxylic acids and derivativesdialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidessulfonyls |
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| Substituents | aliphatic acyclic compoundsecondary aliphatic aminecarbonyl groupamino acid or derivativesorganosulfonic acidsecondary amineorganosulfur compoundcarboxamide groupcarboxylic acid derivativesecondary carboxylic acid amideorganic oxidesulfonylorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundacetamideorganooxygen compoundamine |
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