| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:54:48 UTC |
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| Update Date | 2025-03-21 18:04:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00050049 |
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| Frequency | 65.7 |
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| Structure | |
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| Chemical Formula | C7H11N3O |
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| Molecular Mass | 153.0902 |
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| SMILES | NC(=O)C(N)Cc1cc[nH]c1 |
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| InChI Key | GSDJCQRLVRHONI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acids and derivativesfatty amidesheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidespyrroles |
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| Substituents | primary carboxylic acid amidefatty acylcarbonyl grouparomatic heteromonocyclic compoundazacycleheteroaromatic compoundfatty amidecarboxamide grouporganic oxideorganic oxygen compoundpyrroleorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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