| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:34:57 UTC |
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| Update Date | 2025-03-21 17:56:48 UTC |
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| HMDB ID | HMDB0244201 |
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| Metabolite Identification |
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| DeepMet ID | DMID00003761 |
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| Name | 1,4-Butanediol |
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| Frequency | 1535.2 |
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| Structure | |
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| Chemical Formula | C4H10O2 |
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| Molecular Mass | 90.0681 |
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| SMILES | OCCCCO |
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| InChI Key | WERYXYBDKMZEQL-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | alcohols and polyols |
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| Direct Parent | alcohols and polyols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivatives |
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| Substituents | alcoholaliphatic acyclic compoundhydrocarbon derivative |
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