| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:47:30 UTC |
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| Update Date | 2025-03-25 00:25:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01317133 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C7H12N2O |
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| Molecular Mass | 140.095 |
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| SMILES | CC(CO)Cc1ccn[nH]1 |
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| InChI Key | ZBCBABOGNDWBMR-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 derivativesorganonitrogen compoundsorganopnictogen compoundsprimary alcohols |
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| Substituents | alcoholaromatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrazoleorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholorganooxygen compound |
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