Analyte Name

L-Isolecucine 7-Amido-4-methylcoumarin Trifluoroacetate Salt

CAS Number

191723-68-9

Molecular Formula

C16H20N2O3 . C2HF3O2

Molecular Weight

402.37

Accurate Mass

402.14

SMILES

OC(C(F)(F)F)=O.CC(C1=CC=C(NC([C@@H](N)[C@@H](C)CC)=O)C=C1O2)=CC2=O

InChI

InChI=1S/C16H20N2O3.C2HF3O2/c1-4-9(2)15(17)16(20)18-11-5-6-12-10(3)7-14(19)21-13(12)8-11;3-2(4,5)1(6)7/h5-9,15H,4,17H2,1-3H3,(H,18,20);(H,6,7)/t9-,15-;/m0./s1

IUPAC

(2S,3S)-2-amino-3-methyl-N-(4-methyl-2-oxo-2H-chromen-7-yl)pentanamide 2,2,2-trifluoroacetate

Alternate CAS Number

free acid 98516-74-6

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Bioactive Small Molecule

Product Format

Neat