| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:10:35 UTC |
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| Update Date | 2025-03-24 21:03:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01659347 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C17H28N5O26P5 |
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| Molecular Mass | 872.9711 |
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| SMILES | Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OC2C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C2(O)C(=O)O)C(O)C1O |
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| InChI Key | DMFFCVGRIITYOQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | tannins |
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| Subclass | tannins |
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| Direct Parent | tannins |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativesamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidscyclohexanolsdialkyl phosphatesheteroaromatic compoundshydrocarbon derivativeshydrolyzable tanninsimidazolesimidolactamsinositol phosphatesmonoalkyl phosphatesmonocarboxylic acids and derivativesmonosaccharidesn-substituted imidazolesorganic oxidesorganopnictogen compoundsoxacyclic compoundspentose phosphatesprimary aminespurine ribonucleoside monophosphatespurines and purine derivativespyrimidines and pyrimidine derivativesquinic acids and derivativestertiary alcoholstetrahydrofurans |
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| Substituents | carboxylic acidamino acid or derivativespurine ribonucleoside monophosphatemonosaccharidepentose-5-phosphateimidazopyrimidinesaccharidetanninorganonitrogen compoundorganoheterocyclic compoundhydrolyzable tanninalcoholazacycleheteroaromatic compoundcyclohexanolcyclitol or derivativesmonoalkyl phosphatehydrocarbon derivativeprimary amineaminequinic acidcarbonyl grouppentose phosphateamino acidalpha-hydroxy acidinositol phosphatecarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganopnictogen compoundimidolactamazolen-substituted imidazoletetrahydrofuranhydroxy acidcyclic alcoholoxacycledialkyl phosphatetertiary alcoholmonocarboxylic acid or derivativesorganic oxygen compoundphosphoric acid estersecondary alcoholpurineorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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