| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-21 00:01:04 UTC |
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| Update Date | 2025-03-21 18:06:42 UTC |
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| HMDB ID | HMDB0255538 |
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| Metabolite Identification |
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| DeepMet ID | DMID00064684 |
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| Name | Neplanocin A |
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| Frequency | 47.5 |
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| Structure | |
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| Chemical Formula | C11H13N5O3 |
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| Molecular Mass | 263.1018 |
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| SMILES | Nc1ncnc2c1ncn2C1C=C(CO)C(O)C1O |
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| InChI Key | XUGWUUDOWNZAGW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | nucleosides, nucleotides, and analogues |
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| Class | purine nucleosides |
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| Subclass | purine nucleosides |
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| Direct Parent | purine nucleosides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-substituted cyclopentyl purine nucleosidesazacyclic compoundscyclopentyl nucleosidesheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsn-substituted imidazolesorganopnictogen compoundsprimary aminespurines and purine derivativespyrimidines and pyrimidine derivativessecondary alcohols |
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| Substituents | imidazopyrimidinepyrimidinearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundimidolactamorganoheterocyclic compoundazolen-substituted imidazolecyclopentyl nucleosidealcoholazacyclepurine nucleosideheteroaromatic compound1,3-substituted cyclopentyl purine nucleosideorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary aminepurineorganic nitrogen compoundamineorganooxygen compound |
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