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CHEBI:125381 - (1R,3S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester

ChEBI IDCHEBI:125381
ChEBI Name(1R,3S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester
Stars
DownloadsMolfile
FormulaC16H20INO2
Net Charge0
Average Mass385.245
Monoisotopic Mass385.05388
SMILESCOC(=O)C1C2CC[C@H](C[C@@H]1c1ccc(I)cc1)N2C
InChIInChI=1S/C16H20INO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14?,15?/m1/s1
InChIKeySIIICDNNMDMWCI-LMRVLLHPSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,3S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester (CHEBI:125381) has parent hydride tropane (CHEBI:35615)
(1R,3S)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester (CHEBI:125381) is a azabicycloalkane (CHEBI:38295)
Manual XrefsDatabases
LSM-36863LINCS