| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:00:27 UTC |
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| Update Date | 2025-03-21 18:06:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00063211 |
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| Frequency | 48.9 |
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| Structure | |
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| Chemical Formula | C9H15NO3 |
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| Molecular Mass | 185.1052 |
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| SMILES | COC(=O)C1C(O)CC2CCC1N2 |
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| InChI Key | DTIRBMVDLCFJDP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | alkaloids and derivatives |
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| Class | tropane alkaloids |
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| Subclass | tropane alkaloids |
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| Direct Parent | tropane alkaloids |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | amino acids and derivativesazacyclic compoundsbeta hydroxy acids and derivativescarbonyl compoundscyclic alcohols and derivativesdialkylamineshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspiperidinecarboxylic acidspiperidinespyrrolidinessecondary alcohols |
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| Substituents | carbonyl groupamino acid or derivativescarboxylic acid derivativealiphatic heteropolycyclic compoundbeta-hydroxy acidorganic oxidemethyl esterorganonitrogen compoundorganopnictogen compoundpiperidinecarboxylic acidpiperidinepyrrolidineorganoheterocyclic compoundalcoholsecondary aliphatic amineazacyclehydroxy acidcyclic alcoholsecondary aminemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativeorganic nitrogen compoundtropane alkaloidorganooxygen compoundamine |
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