Vitas-M small molecule compound
9-{2-[(2-fluorobenzyl)oxy]phenyl}-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK198893
SMILES O=C1CCCC2=C1C(C1=C(O2)CCCC1=O)c1ccccc1OCc1ccccc1F
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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 C26H23FO4 MW 418.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23FO4/c27-18-9-3-1-7-16(18)15-30-21-12-4-2-8-17(21)24-25-19(28)10-5-13-22(25)31-23-14-6-11-20(29)26(23)24/h1-4,7-9,12,24H,5-6,10-11,13-15H2InChIKey
IJYLENGQFYMMRJ-UHFFFAOYSA-NSynonyms
9(2((2fluorobenzyl)oxy)phenyl)345679hexahydro1Hxanthene18(2H)dione
9(2((2fluorophenyl)methoxy)phenyl)345679hexahydro2Hxanthene18dione
C1CC2=C(C(C3=C(O2)CCCC3=O)C4=CC=CC=C4OCC5=CC=CC=C5F)C(=O)C1
InChI=1SC26H23FO4c2718931716(18)1530211242817(21)242519(28)1051322(25)31231461120(29)26(23)24h14791224H5610111315H2
MFCD03707646
ZINC000001156969
ZINC01156969
ZINC1156969
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