| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:43:17 UTC |
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| Update Date | 2025-03-21 17:59:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00022662 |
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| Frequency | 174.7 |
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| Structure | |
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| Chemical Formula | C27H32N2O2 |
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| Molecular Mass | 416.2464 |
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| SMILES | OC(CCCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1)c1cccnc1 |
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| InChI Key | XSGPCCQYKYUACJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | diphenylmethanes |
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| Direct Parent | diphenylmethanes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganopnictogen compoundspiperidinessecondary alcoholstertiary alcoholstrialkylamines |
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| Substituents | aromatic alcoholalcoholdiphenylmethanearomatic heteromonocyclic compoundazacycleheteroaromatic compoundtertiary aliphatic aminehydroxypyridinetertiary alcoholpyridineorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpiperidineaminetertiary amineorganoheterocyclic compoundorganooxygen compound |
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