Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:41:15 UTC |
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Update Date | 2025-03-25 00:46:58 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02158561 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C27H31NO2 |
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Molecular Mass | 401.2355 |
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SMILES | OC(CCCN1CCC(Oc2ccccc2)CC1)(c1ccccc1)c1ccccc1 |
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InChI Key | ABLYDNBHQAPGDB-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 | alkyl aryl ethersaromatic alcoholsazacyclic compoundshydrocarbon derivativesorganopnictogen compoundsphenol ethersphenoxy compoundsphenylbutylaminespiperidinestertiary alcoholstrialkylamines |
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Substituents | aromatic alcoholdiphenylmethanephenol etheretheraromatic heteromonocyclic compoundalkyl aryl etherphenylbutylamineorganonitrogen compoundorganopnictogen compoundpiperidinetertiary amineorganoheterocyclic compoundalcoholazacycletertiary aliphatic aminetertiary alcoholorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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