Vitas-M small molecule compound
6-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-3-(3-methoxyphenyl)-5-methyl-7H-furo[3,2-g]chromen-7-one
Catalog ID
STL536922
SMILES COc1cccc(c1)c1coc2c1cc1c(c2)oc(=O)c(c1C)CCC(=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 C31H33NO6 MW 515.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33NO6/c1-19-23(9-10-29(33)32-13-12-31(35)11-4-3-7-21(31)17-32)30(34)38-28-16-27-25(15-24(19)28)26(18-37-27)20-6-5-8-22(14-20)36-2/h5-6,8,14-16,18,21,35H,3-4,7,9-13,17H2,1-2H3InChIKey
ZDCJDJZJGOQERA-UHFFFAOYSA-NSynonyms
3706246
6(3(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)3oxopropyl)3(3methoxyphenyl)5methylfuro(32g)chromen7one
6(3(4ahydroxyoctahydroisoquinolin2(1H)yl)3oxopropyl)3(3methoxyphenyl)5methyl7Hfuro(32g)chromen7one
InChI=1SC31H33NO6c11923(91029(33)32131231(35)1143721(31)1732)30(34)3828162725(1524(19)28)26(183727)2065822(1420)362h5681416182135H34791317H212H3
MFCD31754485
ZINC000002111692
ZINC000015954973
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