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CHEBI:95332 - 1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]-2-propanol

ChEBI IDCHEBI:95332
ChEBI Name1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]-2-propanol
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Formula2C18H31NO4
Net Charge0
Average Mass650.898
Monoisotopic Mass650.45062
SMILESCC(C)NCC(O)COc1ccc(COCCOC(C)C)cc1.CC(C)NCC(O)COc1ccc(COCCOC(C)C)cc1
InChIInChI=1S/2C18H31NO4/c2*1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4/h2*5-8,14-15,17,19-20H,9-13H2,1-4H3
InChIKeyQBTVIXAPCFNMDR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]-2-propanol (CHEBI:95332) is a benzyl ether (CHEBI:59859)
Manual XrefsDatabases
LSM-6698LINCS