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Dolutegravir-[d6]

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General Information
Catalog: BLP-013858
CAS: 1407166-95-3
Molecular Formula: C20H13D6F2N3O5
Molecular Weight: 425.42

Chemical Structure

Description	Dolutegravir-[d6] is the labelled analogue of Dolutegravir, which is an antiretroviral medication used to treat HIV/AIDS.
Synonyms	Dolutegravir-d6; (4R,12aS)-N-[(2,4-Difluorophenyl)methyl-d2]-3,4,6,8,12,12a-hexahydro-7-hydroxy-4-(methyl-d3)-6,8-dioxo-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-4-d-9-carboxamide
IUPAC Name	(3S,7R)-7-deuterio-N-[dideuterio-(2,4-difluorophenyl)methyl]-11-hydroxy-9,12-dioxo-7-(trideuteriomethyl)-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-13-carboxamide
Related CAS	1051375-16-6 (unlabelled)
Canonical SMILES	CC1CCOC2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)NCC4=C(C=C(C=C4)F)F)O
InChI	InChI=1S/C20H19F2N3O5/c1-10-4-5-30-15-9-24-8-13(17(26)18(27)16(24)20(29)25(10)15)19(28)23-7-11-2-3-12(21)6-14(11)22/h2-3,6,8,10,15,27H,4-5,7,9H2,1H3,(H,23,28)/t10-,15+/m1/s1/i1D3,7D2,10D
InChI Key	RHWKPHLQXYSBKR-FCNOLGEFSA-N
Purity	98%; 98% atom D
Solubility	Soluble in DMSO (Slightly, Heated, Sonicated), Methanol (Slightly, Heated, Sonicated)
Appearance	Pale Beige Solid
Storage	Store at 2-8°C