| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:43:14 UTC |
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| Update Date | 2025-03-25 00:47:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02162986 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C25H27N3O5S |
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| Molecular Mass | 481.1671 |
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| SMILES | C=CC1=C(C)C(C)=C(CCC(=O)O)C1=Cc1[nH]c(C=C2NC(=S)NC2=O)c(C)c1CCC(=O)O |
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| InChI Key | SADYATTZBUTZLI-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 acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolidinonesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolesthioureas |
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| Substituents | imidazolidinecarbonyl groupthioureacarboxylic acidaromatic heteromonocyclic compoundazacycleheteroaromatic compoundorganosulfur compoundimidazolidinoneorganic oxideorganic oxygen compoundpyrroleorganonitrogen compoundalpha-amino aciddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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