| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:36 UTC |
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| Update Date | 2025-03-25 00:49:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177636 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C29H30N2O2 |
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| Molecular Mass | 438.2307 |
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| SMILES | N#Cc1ccc2c(c1)COC2CCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 |
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| InChI Key | ZKFBWLZSHRREAX-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 heteropolycyclic compounds |
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| Alternative Parents | aromatic alcoholsazacyclic compoundsdialkyl ethershydrocarbon derivativesisocoumaransnitrilesorganopnictogen compoundsoxacyclic compoundspiperidinestertiary alcoholstrialkylamines |
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| Substituents | aromatic alcoholdiphenylmethaneethernitriledialkyl etherisocoumaranaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpiperidinecarbonitriletertiary amineorganoheterocyclic compoundalcoholazacycletertiary aliphatic amineoxacycletertiary alcoholorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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