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Mycophenolic acid-[d3]

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General Information
Catalog: BLP-012895
CAS: 1185242-90-3
Molecular Formula: C17H17D3O6
Molecular Weight: 323.34

Chemical Structure

Description	Mycophenolic acid-[d3] is the labelled analogue of Mycophenolic Acid, which is an antibiotic produced by Penicillium brevi-compactum, P. Stoloniferum and related spp.
Synonyms	Mycophenolic acid D3; (4E)-6-(1,3-Dihydro-4-hydroxy-6-methoxy-d3-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-4-hexenoic Acid
IUPAC Name	(E)-6-[4-hydroxy-7-methyl-3-oxo-6-(trideuteriomethoxy)-1H-2-benzofuran-5-yl]-4-methylhex-4-enoic acid
Related CAS	24280-93-1 (unlabelled)
Canonical SMILES	CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CCC(=O)O)O
InChI	InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+/i3D3
InChI Key	HPNSFSBZBAHARI-HZIIEIAOSA-N
Melting Point	132-134°C
Purity	97%; ≥99% atom D
Solubility	Soluble in Ethanol (Slightly), Methanol (Slightly)
Appearance	Off-white Solid
Storage	Store at -20°C