Vitas-M small molecule compound
9-[5-(4-chlorophenyl)furan-2-yl]-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK756218
SMILES Clc1ccc(cc1)c1ccc(o1)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C
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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 C27H27ClO4 MW 450.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClO4/c1-26(2)11-17(29)23-21(13-26)32-22-14-27(3,4)12-18(30)24(22)25(23)20-10-9-19(31-20)15-5-7-16(28)8-6-15/h5-10,25H,11-14H2,1-4H3InChIKey
JMCDCFXBFRRLFQ-UHFFFAOYSA-NSynonyms
9(5(4chlorophenyl)furan2yl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(5(4chlorophenyl)furan2yl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC=C(O4)C5=CC=C(C=C5)Cl)C(=O)C1)C
InChI=1SC27H27ClO4c126(2)1117(29)2321(1326)32221427(34)1218(30)24(22)25(23)2010919(3120)155716(28)8615h51025H1114H214H3
MFCD01029542
ZINC000000714046
ZINC00714046
ZINC714046
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