| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:33 UTC |
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| Update Date | 2025-03-25 00:47:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161406 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H29N3S |
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| Molecular Mass | 247.2082 |
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| SMILES | NCCCNCCCCNCCCCCS |
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| InChI Key | ANCBPXBAEPXAGQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | thiols |
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| Subclass | alkylthiols |
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| Direct Parent | alkylthiols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | dialkylamineshydrocarbon derivativesmonoalkylaminesorganopnictogen compoundsorganosulfur compounds |
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| Substituents | aliphatic acyclic compoundsecondary aliphatic amineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundsecondary aminealkylthiolamine |
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