| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:42 UTC |
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| Update Date | 2025-03-21 18:37:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00114469 |
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| Frequency | 23.1 |
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| Structure | |
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| Chemical Formula | C25H36N4O5S |
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| Molecular Mass | 504.2406 |
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| SMILES | CC(C)CN(CC(O)C(Cc1ccccc1)NC(=O)N1CCOCC1)S(=O)(=O)c1ccc(N)cc1 |
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| InChI Key | UTLNXTSVDXRHSB-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 | phenylbutylamines |
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| Direct Parent | phenylbutylamines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aminosulfonyl compoundsamphetamines and derivativesazacyclic compoundsbenzenesulfonamidesbenzenesulfonyl compoundscarbonyl compoundsdialkyl ethershydrocarbon derivativesmorpholine carboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsorganosulfonamidesoxacyclic compoundsprimary aminessecondary alcohols |
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| Substituents | organosulfonic acid or derivativescarbonyl groupetheraromatic heteromonocyclic compoundorganosulfur compounddialkyl etherorganosulfonic acid amideorganic oxidephenylbutylamineorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundamphetamine or derivativesbenzenesulfonyl groupalcoholcarbonic acid derivativebenzenesulfonamideazacycleaminosulfonyl compoundoxazinaneoxacyclemorpholinesulfonylorganic oxygen compoundorganic sulfonic acid or derivativessecondary alcoholhydrocarbon derivativemorpholine-4-carboxylic acid or derivativesprimary amineorganic nitrogen compoundamineorganooxygen compound |
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