Product Code
TRC-P384560-25MG
CAS Number
Product Format
Neat
Molecular Formula
C33 H30 N8 O4
Molecular Weight
602.643
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Analyte Name
N-Phthalimide-linagliptin
CAS Number
886588-63-2
Molecular Formula
C33 H30 N8 O4
Molecular Weight
602.643
Accurate Mass
602.239
SMILES
CC#CCn1c(nc2N(C)C(=O)N(Cc3nc(C)c4ccccc4n3)C(=O)c12)N5CCC[C@H](C5)N6C(=O)c7ccccc7C6=O
InChI
InChI=1S/C33H30N8O4/c1-4-5-17-39-27-28(37(3)33(45)40(31(27)44)19-26-34-20(2)22-12-8-9-15-25(22)35-26)36-32(39)38-16-10-11-21(18-38)41-29(42)23-13-6-7-14-24(23)30(41)43/h6-9,12-15,21H,10-11,16-19H2,1-3H3/t21-/m1/s1
IUPAC
7-but-2-ynyl-8-[(3R)-3-(1,3-dioxoisoindol-2-yl)piperidin-1-yl]-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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