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Sumatriptan-[d6] Succinate

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General Information
Catalog: BLP-012244
CAS: 1215621-31-0
Molecular Formula: C18H21D6N3O6S
Molecular Weight: 419.53

Chemical Structure

Description	Sumatriptan-[d6] Succinate is the labelled analogue of Sumatriptan. Sumatriptan is a Serotonin-1b and Serotonin-1d Receptor Agonist that acts selectively at 5HT1 receptors. It is a sulfonamide triptan with vasoconstrictor activity. It selectively binds to and activates serotonin 5-HT1D receptors in the central nervous system, thus constricts cerebral blood vessels. It may also relieve vascular headaches by decreasing the release of vasoactive neuropeptides from perivascular trigeminal axons in the dura mater. It is a medication used for the treatment of migraine headaches.
Synonyms	Sumatriptan-D6 Succinate
IUPAC Name	1-[3-[2-[bis(trideuteriomethyl)amino]ethyl]-1H-indol-5-yl]-N-methylmethanesulfonamide;butanedioic acid
Related CAS	103628-48-4 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])N(CCC1=CNC2=C1C=C(C=C2)CS(=O)(=O)NC)C([2H])([2H])[2H].C(CC(=O)O)C(=O)O
Canonical SMILES	CNS(=O)(=O)CC1=CC2=C(C=C1)NC=C2CCN(C)C.C(CC(=O)O)C(=O)O
InChI	InChI=1S/C14H21N3O2S.C4H6O4/c1-15-20(18,19)10-11-4-5-14-13(8-11)12(9-16-14)6-7-17(2)3;5-3(6)1-2-4(7)8/h4-5,8-9,15-16H,6-7,10H2,1-3H3;1-2H2,(H,5,6)(H,7,8)/i2D3,3D3;
InChI Key	PORMUFZNYQJOEI-HVTBMTIBSA-N
Melting Point	165-166°C (dec.)
Purity	98% by HPLC; 99% atom D
Solubility	Soluble in Water
Appearance	Off-white Solid
Application	Labelled Sumatriptan, a serotonin 5HT1-receptor agonist.
Storage	Store at -20°C