Vitas-M small molecule compound
3-{4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2-oxo-2H-chromen-3-yl}-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]propanamide
Catalog ID
STL535474
SMILES CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NC[C@@H]1CCCN2[C@@H]1CCCC2
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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 C27H36N2O4 MW 452.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N2O4/c1-18(2)17-32-21-9-10-22-19(3)23(27(31)33-25(22)15-21)11-12-26(30)28-16-20-7-6-14-29-13-5-4-8-24(20)29/h9-10,15,20,24H,1,4-8,11-14,16-17H2,2-3H3,(H,28,30)/t20-,24+/m0/s1InChIKey
UIIWXOVXQAFVKG-GBXCKJPGSA-NSynonyms
1212493-71-4~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)3(4methyl7(2methylprop2enoxy)2oxochromen3yl)propanamide
1212493714
3(4methyl7((2methylallyl)oxy)2oxo2Hchromen3yl)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)propanamide
3(4methyl7((2methylprop2en1yl)oxy)2oxo2Hchromen3yl)N((1S9aR)octahydro2Hquinolizin1ylmethyl)propanamide
42506706
CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NC(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC27H36N2O4c118(2)1732219102219(3)23(27(31)3325(22)1521)111226(30)2816207614291354824(20)29h910152024H14811141617H223H3(H2830)t2024+m0s1
ZINC000012296454
ZINC12296454
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