Type : Coumarin, Chromen, 7-amido-4-methylcoumarin, Peptide, Pyrrolidine, Sulfur Compound
Chemical_Nomenclature : (2S)-1-[2-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]acetyl]-N-(4-methyl-2-oxochromen-7-yl)pyrrolidine-2-carboxamide
Canonical SMILES : CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@@H]3CCCN3C(=O)CNC(=O)[C@H](CCSC)N
InChI : InChI=1S\/C22H28N4O5S\/c1-13-10-20(28)31-18-11-14(5-6-15(13)18)25-22(30)17-4-3-8-26(17)19(27)12-24-21(29)16(23)7-9-32-2\/h5-6,10-11,16-17H,3-4,7-9,12,23H2,1-2H3,(H,24,29)(H,25,30)\/t16-,17-\/m0\/s1
InChIKey : SBIKNEVHKGLANK-IRXDYDNUSA-N
Other name(s) : H-Met-Gly-Pro-AMC || SCHEMBL29543700 || HY-P4344 || DA-55369 || CS-0653711
MW : 460.5
Formula : C22H28N4O5S
CAS_number : 1926163-52-1
PubChem : 124356848
UniChem : SBIKNEVHKGLANK-IRXDYDNUSA-N
Families : Met-Gly-Pro-AMC ligand of proteins in family
DPP4N_Peptidase_S9
Protein :
human-DPP4
caeel-K02F2.1
No reference