Vitas-M small molecule compound

9-{1-[4-(propan-2-yl)phenyl]propan-2-yl}-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione

Catalog ID
STK531040
SMILES CC(c1ccc(cc1)CC(C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2)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 C25H30O3 MW 378.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30O3/c1-15(2)18-12-10-17(11-13-18)14-16(3)23-24-19(26)6-4-8-21(24)28-22-9-5-7-20(27)25(22)23/h10-13,15-16,23H,4-9,14H2,1-3H3
InChIKey
TZUMUGLNHNZAKZ-UHFFFAOYSA-N
Synonyms
353769-38-7
353769387
9(1(4(propan2yl)phenyl)propan2yl)345679hexahydro1Hxanthene18(2H)dione
9(1(4isopropylphenyl)propan2yl)345679hexahydro1Hxanthene18(2H)dione
9(1(4propan2ylphenyl)propan2yl)345679hexahydro2Hxanthene18dione
CC(C)C1=CC=C(C=C1)CC(C)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4
InChI=1SC25H30O3c115(2)18121017(111318)1416(3)232419(26)64821(24)282295720(27)25(22)23h1013151623H4914H213H3
MFCD01578214
ZINC000002299253
ZINC000002299254

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Available files

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