Record Information |
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HMDB Status | expected |
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Creation Date | 2024-02-20 23:35:27 UTC |
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Update Date | 2025-03-21 17:56:59 UTC |
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HMDB ID | HMDB0034370 |
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Metabolite Identification |
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DeepMet ID | DMID00004906 |
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Name | Ibervirin |
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Frequency | 1118.0 |
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Structure | |
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Chemical Formula | C5H9NS2 |
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Molecular Mass | 147.0176 |
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SMILES | CSCCCN=C=S |
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InChI Key | LDKSCZJUIURGMW-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 | isothiocyanates |
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Subclass | isothiocyanates |
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Direct Parent | isothiocyanates |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | dialkylthioethershydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssulfenyl compounds |
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Substituents | aliphatic acyclic compoundisothiocyanatesulfenyl compounddialkylthioetherorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundthioetherorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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