Vitas-M small molecule compound
3-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-8-methoxy-6H-benzo[c]chromen-6-one
Catalog ID
STL549134
SMILES COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OCC(=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 C25H27NO6 MW 437.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO6/c1-30-17-5-7-19-20-8-6-18(13-22(20)32-24(28)21(19)12-17)31-15-23(27)26-11-10-25(29)9-3-2-4-16(25)14-26/h5-8,12-13,16,29H,2-4,9-11,14-15H2,1H3InChIKey
JBMCOTJEJYLIDL-UHFFFAOYSA-NSynonyms
3(2(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)2oxoethoxy)8methoxybenzo(c)chromen6one
3(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethoxy)8methoxy6Hbenzo(c)chromen6one
3586003
InChI=1SC25H27NO6c130175719208618(1322(20)3224(28)21(19)1217)311523(27)26111025(29)932416(25)1426h5812131629H249111415H21H3
MFCD31756874
ZINC000002110645
ZINC000015954538
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