| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:41:48 UTC |
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| Update Date | 2025-03-24 22:19:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01158426 |
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| Frequency | 1.2 |
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| Structure | |
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| Chemical Formula | C5H7N |
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| Molecular Mass | 81.0578 |
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| SMILES | CC1=NCC=C1 |
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| InChI Key | XXTXAFASROUSBD-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 | imines |
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| Direct Parent | ketimines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundshydrocarbon derivativesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | ketimineazacyclealiphatic heteromonocyclic compoundorganopnictogen compoundhydrocarbon derivativeorganic 1,3-dipolar compoundorganoheterocyclic compoundpropargyl-type 1,3-dipolar organic compound |
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