Vitas-M small molecule compound
3-[9-(4-fluorophenyl)-3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydroacridin-10(1H)-yl]benzoic acid
Catalog ID
STK914488
SMILES Fc1ccc(cc1)C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)c1cccc(c1)C(=O)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 C30H30FNO4 MW 487.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30FNO4/c1-29(2)13-21-26(23(33)15-29)25(17-8-10-19(31)11-9-17)27-22(14-30(3,4)16-24(27)34)32(21)20-7-5-6-18(12-20)28(35)36/h5-12,25H,13-16H2,1-4H3,(H,35,36)InChIKey
FVIXNPDLRBFTNH-UHFFFAOYSA-NSynonyms
3(9(4fluorophenyl)3366tetramethyl18dioxo23456789octahydroacridin10(1H)yl)benzoicacid
3(9(4fluorophenyl)3366tetramethyl18dioxo4579tetrahydro2Hacridin10yl)benzoicacid
CC1(CC2=C(C(C3=C(N2C4=CC=CC(=C4)C(=O)O)CC(CC3=O)(C)C)C5=CC=C(C=C5)F)C(=O)C1)C
InChI=1SC30H30FNO4c129(2)132126(23(33)1529)25(1781019(31)11917)2722(1430(34)1624(27)34)32(21)2075618(1220)28(35)36h51225H1316H214H3(H3536)
MFCD14713943
ZINC000009775610
ZINC9775610
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