| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:52 UTC |
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| Update Date | 2025-03-25 00:51:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02185001 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H21N3O7 |
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| Molecular Mass | 331.138 |
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| SMILES | OCC1OC(n2ccc(NC3OC(CO)C(O)C3O)n2)CC1O |
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| InChI Key | RPAILUDNPQKKHN-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | amines |
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| Direct Parent | secondary alkylarylamines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmonosaccharidesorganopnictogen compoundsoxacyclic compoundsprimary alcoholspyrazolessecondary alcoholstetrahydrofurans |
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| Substituents | alcoholaromatic heteromonocyclic compoundazacycletetrahydrofuranheteroaromatic compoundmonosaccharidepyrazolesecondary aliphatic/aromatic amineoxacyclesaccharideorganic oxygen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary alcoholimidolactamorganoheterocyclic compoundorganooxygen compoundazole |
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