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CHEBI:125185 - 1-azocanyl-[(2R,4R)-2-(4-hydroxybutoxy)-4-thiophen-2-yl-3,4-dihydro-2H-pyran-6-yl]methanone

ChEBI IDCHEBI:125185
ChEBI Name1-azocanyl-[(2R,4R)-2-(4-hydroxybutoxy)-4-thiophen-2-yl-3,4-dihydro-2H-pyran-6-yl]methanone
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FormulaC21H31NO4S
Net Charge0
Average Mass393.549
Monoisotopic Mass393.19738
SMILESO=C(C1=C[C@H](c2cccs2)C[C@H](OCCCCO)O1)N1CCCCCCC1
InChIInChI=1S/C21H31NO4S/c23-12-6-7-13-25-20-16-17(19-9-8-14-27-19)15-18(26-20)21(24)22-10-4-2-1-3-5-11-22/h8-9,14-15,17,20,23H,1-7,10-13,16H2/t17-,20+/m0/s1
InChIKeyMROKZHDMMQEAJY-FXAWDEMLSA-N
ChEBI Ontology
Outgoing Relation(s)
1-azocanyl-[(2R,4R)-2-(4-hydroxybutoxy)-4-thiophen-2-yl-3,4-dihydro-2H-pyran-6-yl]methanone (CHEBI:125185) is a heteroarene (CHEBI:33833)
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