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rac 4-Hydroxymethyl Ambrisentan-[d3]

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General Information
Catalog: BLP-003987
CAS: 1287096-42-7
Molecular Formula: C22H19D3N2O5
Molecular Weight: 397.44

Chemical Structure

Description	rac 4-Hydroxymethyl Ambrisentan-[d3], is the labelled analogue of rac 4-Hydroxymethyl Ambrisentan, which is a metabolite of Ambrisentan. Ambrisentan is a drug indicated for use in the treatment of pulmonary hypertension.
Synonyms	α-[[4-(Hydroxymethyl)-6-(methyl-d3)-2-pyrimidinyl]oxy]-β-methoxy-β-phenylbenzenepropanoic Acid; rac 4-Hydroxymethyl Ambrisentan D3
IUPAC Name	2-[4-(hydroxymethyl)-6-(trideuteriomethyl)pyrimidin-2-yl]oxy-3-methoxy-3,3-diphenylpropanoic acid
Related CAS	1106685-84-0 (unlabelled)
Canonical SMILES	CC1=CC(=NC(=N1)OC(C(=O)O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC)CO
InChI	InChI=1S/C22H22N2O5/c1-15-13-18(14-25)24-21(23-15)29-19(20(26)27)22(28-2,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-13,19,25H,14H2,1-2H3,(H,26,27)/i1D3
InChI Key	PDUAYPFMBRYSNN-FIBGUPNXSA-N
Boiling Point	600.0±60.0°C at 760 mmHg
Density	1.3±0.1 g/cm3
Storage	Store at 2-8°C