| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:43:03 UTC |
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| Update Date | 2025-03-24 20:26:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01449662 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C5H9N3O |
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| Molecular Mass | 127.0746 |
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| SMILES | NCCc1c[nH][n+]([O-])c1 |
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| InChI Key | VLDVPVUFADBONX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | azoles |
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| Subclass | pyrazoles |
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| Direct Parent | pyrazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrazoleorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound |
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