| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:12:42 UTC |
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| Update Date | 2025-03-21 18:32:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00092467 |
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| Frequency | 30.3 |
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| Structure | |
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| Chemical Formula | C17H19N7O4 |
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| Molecular Mass | 385.1499 |
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| SMILES | CC(O)C(=O)NC(=O)c1ccc(NCC2=Nc3c([nH]c(N)nc3=O)NC2)cc1 |
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| InChI Key | NDBMACMVFJOSSJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | pteridines and derivatives |
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| Subclass | pterins and derivatives |
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| Direct Parent | pterins and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acids and derivativesazacyclic compoundsbenzoic acids and derivativesbenzoyl derivativescarbonyl compoundscarboxylic acids and derivativesdicarboximidesheteroaromatic compoundshydrocarbon derivativesketiminesn-unsubstituted carboxylic acid imidesorganic oxidesorganopnictogen compoundsphenylalkylaminesprimary aminespropargyl-type 1,3-dipolar organic compoundspyrimidonessecondary alcoholssecondary alkylarylaminesvinylogous amides |
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| Substituents | ketiminemonocyclic benzene moietycarbonyl groupamino acid or derivativesiminebenzoylpyrimidonecarboxylic acid derivativepyrimidinepropargyl-type 1,3-dipolar organic compoundcarboxylic acid imide, n-unsubstitutedorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compounddicarboximidealcoholvinylogous amidepterinazacycleheteroaromatic compoundbenzoic acid or derivativesorganic 1,3-dipolar compoundsecondary aminesecondary aliphatic/aromatic aminecarboxylic acid imideorganic oxygen compoundsecondary alcoholphenylalkylaminehydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundamineorganooxygen compound |
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