Vitas-M small molecule compound
2-[(4-butyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]acetamide
Catalog ID
STL537105
SMILES CCCCc1cc(=O)oc2c1ccc(c2C)OCC(=O)NCC(=O)N1CCC2(C(C1)CCCC2)O
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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 C27H36N2O6 MW 484.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N2O6/c1-3-4-7-19-14-25(32)35-26-18(2)22(10-9-21(19)26)34-17-23(30)28-15-24(31)29-13-12-27(33)11-6-5-8-20(27)16-29/h9-10,14,20,33H,3-8,11-13,15-17H2,1-2H3,(H,28,30)InChIKey
IHPFWMUKTHBQSH-UHFFFAOYSA-NSynonyms
~(N)(2(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)2oxoethyl)2(4butyl8methyl2oxochromen7yl)oxyacetamide
2((4butyl8methyl2oxo2Hchromen7yl)oxy)N(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethyl)acetamide
4521499
InChI=1SC27H36N2O6c1347191425(32)352618(2)22(10921(19)26)341723(30)281524(31)29131227(33)1165820(27)1629h910142033H3811131517H212H3(H2830)
MFCD31754493
ZINC000002109667
ZINC000015954329
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