| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:17:31 UTC |
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| Update Date | 2025-03-24 20:15:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01389049 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C4H6N2O2 |
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| Molecular Mass | 114.0429 |
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| SMILES | Cc1c(O)[nH][nH]c1=O |
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| InChI Key | CXDUSMLEPWPRTG-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 | azolines |
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| Subclass | pyrazolines |
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| Direct Parent | pyrazolones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrazolesvinylogous acidsvinylogous amides |
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| Substituents | vinylogous amidelactamaromatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrazolevinylogous acidorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundazolepyrazolinone |
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