| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:48 UTC |
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| Update Date | 2025-03-21 18:39:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00124148 |
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| Frequency | 45.7 |
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| Structure | |
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| Chemical Formula | C12H16N4O7 |
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| Molecular Mass | 328.1019 |
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| SMILES | Nc1nc2[nH]cc(OC3OC(CO)C(O)C(O)C3O)c2c(=O)[nH]1 |
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| InChI Key | QZXHGLCDKOPSSD-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 | pyrrolopyrimidines |
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| Subclass | pyrrolo[2,3-d]pyrimidines |
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| Direct Parent | pyrrolo[2,3-d]pyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | acetalsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsmonosaccharidesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholsprimary aminespyrimidonespyrrolessecondary alcoholsvinylogous amidesvinylogous esters |
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| Substituents | lactammonosaccharidepyrimidonepyrimidinesaccharideorganic oxidepyrrolo[2,3-d]pyrimidineacetalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholalcoholvinylogous amideazacyclevinylogous esterheteroaromatic compoundoxacycleorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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