| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:04 UTC |
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| Update Date | 2025-03-25 00:59:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02237988 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H11NO5 |
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| Molecular Mass | 201.0637 |
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| SMILES | O=C(O)CC1OC2C(C(=O)O)NCC12 |
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| InChI Key | BCEPBNWURIAGTC-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 | aliphatic heteropolycyclic compounds |
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| Alternative Parents | 1,4-oxazepinesamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkyl ethersdialkylaminesdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxetanespyrrolidine carboxylic acids |
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| Substituents | carbonyl groupethercarboxylic acidamino aciddialkyl etheraliphatic heteropolycyclic compoundorganic oxidepyrrolidine carboxylic acidorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundsecondary aliphatic amineazacyclesecondary aminepara-oxazepineoxacyclepyrrolidine carboxylic acid or derivativesorganic oxygen compoundoxetanedicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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