Vitas-M small molecule compound
N-[(6,7-dimethoxy-1-phenyl-3,4-dihydroisoquinolin-2(1H)-yl)carbonyl]-D-phenylalanine
Catalog ID
STL457200
SMILES COc1cc2c(cc1OC)CCN(C2c1ccccc1)C(=O)N[C@@H](C(=O)O)Cc1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H28N2O5 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O5/c1-33-23-16-20-13-14-29(25(19-11-7-4-8-12-19)21(20)17-24(23)34-2)27(32)28-22(26(30)31)15-18-9-5-3-6-10-18/h3-12,16-17,22,25H,13-15H2,1-2H3,(H,28,32)(H,30,31)/t22-,25?/m1/s1InChIKey
OXAUVGQJEVPWSI-UFUCKMQHSA-NSynonyms
(2R)2((67dimethoxy1phenyl34dihydro1Hisoquinoline2carbonyl)amino)3phenylpropanoicacid
(2S)2(67dimethoxy1phenyl1234tetrahydroisoquinoline2carboxamido)3phenylpropanoicacid
COC1=C(C=C2C(N(CCC2=C1)C(=O)NC(CC3=CC=CC=C3)C(=O)O)C4=CC=CC=C4)OC
COc1cc2c(cc1OC)CCN(C2c1ccccc1)C(=O)N(C@@H)(C(=O)O)Cc1ccccc1
COc1cc2c(cc1OC)CCN(C2c1ccccc1)C(=O)N(C@H)(C(=O)O)Cc1ccccc1
InChI=1SC27H28N2O5c133231620131429(25(19117481219)21(20)1724(23)342)27(32)2822(26(30)31)151895361018h31216172225H1315H212H3(H2832)(H3031)t2225?m1s1
N((67dimethoxy1phenyl34dihydroisoquinolin2(1H)yl)carbonyl)Dphenylalanine
ZINC000011766971
ZINC000011766978
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