
API0233034
Selpercatinib
Selinexor is an anticancer drug (XPO1 inhibitor) used for multiple myeloma.
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CAS No.
2152628-33-4
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Synonyms
Selpercatinib; 2152628-33-4; Retevmo
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CHEMBL ID
CHEMBL4559134
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Indications
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Molecule Type
Small molecule
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Compound CID
134436906
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Molecular Weight (g/mol)
525.6
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Molecular Formula
C29H31N7O3
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InChI
InChI=1S/C29H31N7O3/c1-29(2,37)18-39-24-9-25(28-21(10-30)13-33-36(28)17-24)20-5-6-26(31-12-20)34-15-22-8-23(16-34)35(22)14-19-4-7-27(38-3)32-11-19/h4-7,9,11-13,17,22-23,37H,8,14-16,18H2,1-3H3
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InChIKey
XIIOFHFUYBLOLW-UHFFFAOYSA-N
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SMILES
CC(C)(COC1=CN2C(=C(C=N2)C#N)C(=C1)C3=CN=C(C=C3)N4CC5CC(C4)N5CC6=CN=C(C=C6)OC)O
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IUPAC Name
6-(2-hydroxy-2-methylpropoxy)-4-[6-[6-[(6-methoxypyridin-3-yl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]pyridin-3-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile
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Exact Mass (Da)
525.24883788
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Monoisotopic Mass (Da)
525.24883788
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