Vitas-M small molecule compound

4-butyl-7-hydroxy-8-({(2-methoxyethyl)[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]amino}methyl)-2H-chromen-2-one

Catalog ID
STL578969
SMILES COCCN(Cc1c(O)ccc2c1oc(=O)cc2CCCC)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 C27H40N2O4 MW 456.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H40N2O4/c1-3-4-8-20-17-26(31)33-27-22(20)11-12-25(30)23(27)19-28(15-16-32-2)18-21-9-7-14-29-13-6-5-10-24(21)29/h11-12,17,21,24,30H,3-10,13-16,18-19H2,1-2H3/t21-,24+/m0/s1
InChIKey
NIWGNJSJZZMLKX-XUZZJYLKSA-N
Synonyms

4butyl7hydroxy8(((2methoxyethyl)(((1S9aR)octahydro1Hquinolizin1yl)methyl)amino)methyl)2Hchromen2one
4butyl7hydroxy8(((2methoxyethyl)((1S9aR)octahydro2Hquinolizin1ylmethyl)amino)methyl)2Hchromen2one
COCCN(Cc1c(O)ccc2c1oc(=O)cc2CCCC)C(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC27H40N2O4c1348201726(31)332722(20)111225(30)23(27)1928(1516322)182197142913651024(21)29h111217212430H31013161819H212H3t2124+m0s1
MFCD33397375

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Available files

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