Vitas-M small molecule compound
tert-butyl [(4R,6R)-6-(2-{[(2,5-dimethyl-1H-pyrrol-1-yl)acetyl]amino}ethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate
Catalog ID
STL546980
SMILES O=C(Cn1c(C)ccc1C)NCC[C@@H]1C[C@H](CC(=O)OC(C)(C)C)OC(O1)(C)C
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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 C22H36N2O5 MW 408.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H36N2O5/c1-15-8-9-16(2)24(15)14-19(25)23-11-10-17-12-18(28-22(6,7)27-17)13-20(26)29-21(3,4)5/h8-9,17-18H,10-14H2,1-7H3,(H,23,25)/t17-,18-/m1/s1InChIKey
VUVYNIDENTVFLK-QZTJIDSGSA-NSynonyms
~(tert)butyl2((4~(R)6~(R))6(2((2(25dimethylpyrrol1yl)acetyl)amino)ethyl)22dimethyl13dioxan4yl)acetate
110207337
InChI=1SC22H36N2O5c1158916(2)24(15)1419(25)231110171218(2822(67)2717)1320(26)2921(34)5h891718H1014H217H3(H2325)t1718m1s1
O=C(Cn1c(C)ccc1C)NCC(C@@H)1C(C@H)(CC(=O)OC(C)(C)C)OC(O1)(C)C
tertbutyl((4R6R)6(2(((25dimethyl1Hpyrrol1yl)acetyl)amino)ethyl)22dimethyl13dioxan4yl)acetate
tertbutyl2((4R6R)6(2(2(25dimethyl1Hpyrrol1yl)acetamido)ethyl)22dimethyl13dioxan4yl)acetate
ZINC000253413841
ZINC253413841
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