Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:16:31 UTC |
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Update Date | 2025-03-21 18:34:38 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00101769 |
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Frequency | 26.8 |
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Structure | |
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Chemical Formula | C14H12N6O3 |
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Molecular Mass | 312.0971 |
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SMILES | Nc1nc(=O)c2nc(CNc3ccccc3C(=O)O)cnc2[nH]1 |
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InChI Key | MOZVPWNLNRCQNO-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 | 1-carboxy-2-haloaromatic compoundsamino acidsazacyclic compoundsbenzoic acidsbenzoyl derivativesheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsphenylalkylaminesprimary aminespyrazinespyrimidonessecondary alkylarylaminesvinylogous amides |
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Substituents | monocyclic benzene moietycarboxylic acidamino acid or derivativesamino acidbenzoylpyrimidonecarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1-carboxy-2-haloaromatic compoundbenzoic acidvinylogous amidepterinazacycleheteroaromatic compoundbenzoic acid or derivativessecondary aminesecondary aliphatic/aromatic aminemonocarboxylic acid or derivativesorganic oxygen compoundpyrazinephenylalkylaminehydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundamineorganooxygen compound |
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