Compound Information
Name
SMILES
O=C(NCC1CCC(CN1)O)C2=CC(OCC(F)(F)F)=CC=C2OCC(F)(F)F
InChIKey
KYWPAAOWRFSDBU-UHFFFAOYSA-N
PubChem CID
Mass
430.1327 Da
ALogP
2.6019
Molecular Formula
C17H20F6N2O4
2D Structure

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Biotransformations
Reaction Type: Oxidation of secondary alcohol to ketone (BTMR0079)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: O-Dealkylation (BTMR0052)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: Hydroxylation of heteroalicyclic secondary carbon AndFromCyProduct (BTMR9290)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: Hydroxylation of heteroalicyclic secondary carbon (BTMR1071)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: Hydroxylation from CyProduct (BTMR1328)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: SNP-Oxidation from CyProduct (BTMR1329)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: Hydroxylation from CyProduct (BTMR1328)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: Alkyl-OH-glucuronidation (BTMR0165)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: Sulfation of secondary alcohol (BTMR0502)
Biosystem: Human
Metabolic Enzyme(s):
×