Vitas-M small molecule compound
9-{5-chloro-2-[(3-fluorobenzyl)oxy]phenyl}-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK034152
SMILES Clc1ccc(c(c1)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2)OCc1cccc(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 C26H22ClFO4 MW 452.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClFO4/c27-16-10-11-21(31-14-15-4-1-5-17(28)12-15)18(13-16)24-25-19(29)6-2-8-22(25)32-23-9-3-7-20(30)26(23)24/h1,4-5,10-13,24H,2-3,6-9,14H2InChIKey
HBSRLTNAAGBUCL-UHFFFAOYSA-NSynonyms
9(5chloro2((3fluorobenzyl)oxy)phenyl)345679hexahydro1Hxanthene18(2H)dione
9(5chloro2((3fluorophenyl)methoxy)phenyl)345679hexahydro2Hxanthene18dione
C1CC2=C(C(C3=C(O2)CCCC3=O)C4=C(C=CC(=C4)Cl)OCC5=CC(=CC=C5)F)C(=O)C1
Clc1ccc(c(c1)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2)OCc1cccc(c1)F
InChI=1SC26H22ClFO4c2716101121(31141541517(28)1215)18(1316)242519(29)62822(25)322393720(30)26(23)24h145101324H236914H2
MFCD03707953
STK034152
ZINC000001157934
ZINC01157934
ZINC1157934
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