| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:47 UTC |
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| Update Date | 2025-03-25 00:56:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02217011 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H19N3O6 |
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| Molecular Mass | 385.1274 |
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| SMILES | O=C(O)C(Cc1c[nH]c2ccccc12)N=CC=C1CC(C(=O)O)NC1C(=O)O |
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| InChI Key | VOUVCVUITSNARH-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 | proline and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aldiminesalpha amino acidsamino acidsazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidsdialkylaminesheteroaromatic compoundshydrocarbon derivativesindolesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrrolespyrrolidine carboxylic acidstricarboxylic acids and derivatives |
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| Substituents | carbonyl groupcarboxylic acidamino acidindoleiminetricarboxylic acid or derivativespropargyl-type 1,3-dipolar organic compoundaldimineorganic oxidearomatic heteropolycyclic compoundpyrrolidine carboxylic acidorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundproline or derivativessecondary aliphatic amineazacycleheteroaromatic compoundindole or derivativesorganic 1,3-dipolar compoundsecondary aminepyrrolidine carboxylic acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundamine |
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