Vitas-M small molecule compound
2-[(3-benzyl-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]-N-(2-methoxyethyl)-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]acetamide
Catalog ID
STL546089
SMILES COCCN(C(=O)COc1cc2OC(C)(C)CCc2c2c1c(C)c(c(=O)o2)Cc1ccccc1)C[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 C37H48N2O6 MW 616.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H48N2O6/c1-25-29(21-26-11-6-5-7-12-26)36(41)44-35-28-15-16-37(2,3)45-31(28)22-32(34(25)35)43-24-33(40)39(19-20-42-4)23-27-13-10-18-38-17-9-8-14-30(27)38/h5-7,11-12,22,27,30H,8-10,13-21,23-24H2,1-4H3/t27-,30+/m0/s1InChIKey
FIDBWDDQJHSFAC-BHBYDHKZSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)2((3benzyl488trimethyl2oxo910dihydropyrano(23h)chromen5yl)oxy)~(N)(2methoxyethyl)acetamide
125428309
2((3benzyl488trimethyl2oxo28910tetrahydropyrano(23f)chromen5yl)oxy)N(2methoxyethyl)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)acetamide
2((3benzyl488trimethyl2oxo910dihydro2H8Hpyrano(23f)chromen5yl)oxy)N(2methoxyethyl)N((1S9aR)octahydro2Hquinolizin1ylmethyl)acetamide
COCCN(C(=O)COc1cc2OC(C)(C)CCc2c2c1c(C)c(c(=O)o2)Cc1ccccc1)C(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC37H48N2O6c12529(2126116571226)36(41)443528151637(23)4531(28)2232(34(25)35)432433(40)39(1920424)23271310183817981430(27)38h571112222730H81013212324H214H3t2730+m0s1
ZINC000524729697
ZINC524729697
Check stock
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Check stock on Vitas-MAvailable files
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