Vitas-M small molecule compound
2-ethyl-3-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one
Catalog ID
STL539985
SMILES CCc1cc2c(cc1OCC(=O)N1CCC3(C(C1)CCCC3)O)oc(=O)c1c2CCCC1
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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 C26H33NO5 MW 439.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO5/c1-2-17-13-21-19-8-3-4-9-20(19)25(29)32-23(21)14-22(17)31-16-24(28)27-12-11-26(30)10-6-5-7-18(26)15-27/h13-14,18,30H,2-12,15-16H2,1H3InChIKey
DMIBOEQGDVBRAP-UHFFFAOYSA-NSynonyms
2ethyl3(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethoxy)78910tetrahydro6Hbenzo(c)chromen6one
3(2(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)2oxoethoxy)2ethyl78910tetrahydrobenzo(c)chromen6one
4420696
InChI=1SC26H33NO5c1217132119834920(19)25(29)3223(21)1422(17)311624(28)27121126(30)1065718(26)1527h13141830H2121516H21H3
MFCD31754980
ZINC000002112255
ZINC000015955278
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