| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:39 UTC |
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| Update Date | 2025-03-25 00:59:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02239303 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H10N4O4 |
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| Molecular Mass | 214.0702 |
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| SMILES | Cn1c(=O)nc(NCCC(=O)O)[nH]c1=O |
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| InChI Key | FUEHIZWUSUEKIV-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 | beta amino acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidshalo-s-triazinesheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesn-aliphatic s-triazinesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundssecondary alkylarylaminestriazinones |
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| Substituents | n-aliphatic s-triazinecarbonyl groupamino-1,3,5-triazinecarboxylic acidaromatic heteromonocyclic compoundamino acidorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundcarbonic acid derivativeazacycleaminotriazineheteroaromatic compoundsecondary aminebeta amino acid or derivativessecondary aliphatic/aromatic aminemonocarboxylic acid or derivativesorganic oxygen compoundhalo-s-triazinetriazinehydrocarbon derivative1,3,5-triazineorganic nitrogen compoundtriazinoneorganooxygen compoundamine |
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