Vitas-M small molecule compound
9-{5-chloro-2-[(2-fluorobenzyl)oxy]phenyl}-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK019924
SMILES Clc1ccc(c(c1)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2)OCc1ccccc1F
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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 C26H22ClFO4 MW 452.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClFO4/c27-16-11-12-21(31-14-15-5-1-2-6-18(15)28)17(13-16)24-25-19(29)7-3-9-22(25)32-23-10-4-8-20(30)26(23)24/h1-2,5-6,11-13,24H,3-4,7-10,14H2InChIKey
GUWVUVPKFVJXPM-UHFFFAOYSA-NSynonyms
9(5chloro2((2fluorobenzyl)oxy)phenyl)345679hexahydro1Hxanthene18(2H)dione
9(5chloro2((2fluorophenyl)methoxy)phenyl)345679hexahydro2Hxanthene18dione
C1CC2=C(C(C3=C(O2)CCCC3=O)C4=C(C=CC(=C4)Cl)OCC5=CC=CC=C5F)C(=O)C1
Clc1ccc(c(c1)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2)OCc1ccccc1F
InChI=1SC26H22ClFO4c2716111221(311415512618(15)28)17(1316)242519(29)73922(25)3223104820(30)26(23)24h1256111324H3471014H2
MFCD03707854
STK019924
ZINC000002999055
ZINC02999055
ZINC2999055
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