| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:15 UTC |
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| Update Date | 2025-03-25 00:56:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02218086 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H18N4O4 |
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| Molecular Mass | 294.1328 |
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| SMILES | N=C(N)NCCC(NC(=O)OCc1ccccc1)C(=O)O |
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| InChI Key | RHONIOBQFMBDTO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzyloxycarbonyls |
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| Direct Parent | benzyloxycarbonyls |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alpha amino acidscarbamate esterscarbonyl compoundscarboximidamidescarboxylic acidsguanidineshydrocarbon derivativesiminesmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | benzyloxycarbonylcarbonyl groupcarbonic acid derivativecarboxylic acidguanidineiminecarbamic acid esteralpha-amino acid or derivativescarboximidamidecarboxylic acid derivativearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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