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Maraviroc-M (HO-ring) MS3_1
SpectraBase Compound ID 7dxCc1eAaPq
InChI InChI=1S/5C23H30F2N2O2/c2*24-23(25)12-9-16(10-13-23)22(29)26-21(17-3-1-6-20(28)15-17)11-14-27-18-4-2-5-19(27)8-7-18;2*24-23(25)13-10-16(11-14-23)22(29)26-20(19-6-1-2-7-21(19)28)12-15-27-17-4-3-5-18(27)9-8-17;24-23(25)13-10-17(11-14-23)22(29)26-21(16-4-8-20(28)9-5-16)12-15-27-18-2-1-3-19(27)7-6-18/h2*1-3,6,15-16,18-19,21H,4-5,7-14H2,(H-,26,28,29);2*1-3,6-7,16-18,20H,4-5,8-15H2,(H-,26,28,29);1,4-5,8-9,17-19,21H,2-3,6-7,10-15H2,(H-,26,28,29)/p+5/t2*18-,19+,21?;2*17-,18+,20?;18-,19+,21?
InChIKey ZUGWQNYBMKLBAT-CEEPBPCTSA-S
Mol Weight 405.51 g/mol
Molecular Formula C23H31F2N2O2
Exact Mass 405.23536 g/mol
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