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* Service & Products of Interested: [Isotope Labeled Impurities] 4-Hydroxyphenyl Maraviroc-[d6] (1217513-42-2)
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4-Hydroxyphenyl Maraviroc-[d6]

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General Information
Catalog: BLP-002933
CAS: 1217513-42-2
Molecular Formula: C29H35D6F2N5O2
Molecular Weight: 535.70

Chemical Structure

Description	4-Hydroxyphenyl Maraviroc-[d6] is the labelled analogue of 4-Hydroxyphenyl Maraviroc, which is a metabolite of Maraviroc.
Synonyms	4-Hydroxyphenyl Maraviroc-d6; 4,4-Difluoro-N-[(1S)-1-(4-hydroxyphenyl)-3-[(3-exo)-3-[3-methyl-5-(1-methylethyl-d6)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]oct-8-yl]propyl]-cyclohexanecarboxamide; UK 437719-d6
IUPAC Name	4,4-difluoro-N-[(1S)-3-[3-[3-(1,1,1,3,3,3-hexadeuteriopropan-2-yl)-5-methyl-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octan-8-yl]-1-(4-hydroxyphenyl)propyl]cyclohexane-1-carboxamide
Related CAS	856708-54-8 (unlabelled)
Canonical SMILES	CC1=NN=C(N1C2CC3CCC(C2)N3CCC(C4=CC=C(C=C4)O)NC(=O)C5CCC(CC5)(F)F)C(C)C
InChI	InChI=1S/C29H41F2N5O2/c1-18(2)27-34-33-19(3)36(27)24-16-22-6-7-23(17-24)35(22)15-12-26(20-4-8-25(37)9-5-20)32-28(38)21-10-13-29(30,31)14-11-21/h4-5,8-9,18,21-24,26,37H,6-7,10-17H2,1-3H3,(H,32,38)/t22?,23?,24?,26-/m0/s1/i1D3,2D3
InChI Key	FWOMXCBURQJRQH-HSGIMECWSA-N