Vitas-M small molecule compound
2-(1,3-benzodioxol-5-ylmethyl)-7-fluoro-1-[3-methoxy-4-(3-methylbutoxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Catalog ID
STK818999
SMILES COc1cc(ccc1OCCC(C)C)C1N(Cc2ccc3c(c2)OCO3)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F
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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 C31H28FNO7 MW 545.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28FNO7/c1-17(2)10-11-37-23-8-5-19(13-25(23)36-3)28-27-29(34)21-14-20(32)6-9-22(21)40-30(27)31(35)33(28)15-18-4-7-24-26(12-18)39-16-38-24/h4-9,12-14,17,28H,10-11,15-16H2,1-3H3InChIKey
RHMCJSNQYLRTMB-UHFFFAOYSA-NSynonyms
2(13benzodioxol5ylmethyl)7fluoro1(3methoxy4(3methylbutoxy)phenyl)12dihydrochromeno(23c)pyrrole39dione
2(13BENZODIOXOL5YLMETHYL)7FLUORO1(3METHOXY4(3METHYLBUTOXY)PHENYL)1HCHROMENO(23C)PYRROLE39DIONE
CC(C)CCOC1=C(C=C(C=C1)C2C3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)OC6=C(C3=O)C=C(C=C6)F)OC
InChI=1SC31H28FNO7c117(2)101137238519(1325(23)363)282729(34)211420(32)6922(21)4030(27)31(35)33(28)1518472426(1218)39163824h4912141728H10111516H213H3
MFCD06643173
ZINC000003656159
ZINC000003656160
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