Vitas-M small molecule compound

9-{4-[(3,4-dichlorobenzyl)oxy]-3,5-dimethoxyphenyl}-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione

Catalog ID
STK675121
SMILES COc1cc(cc(c1OCc1ccc(c(c1)Cl)Cl)OC)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 C32H34Cl2O6 MW 585.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34Cl2O6/c1-31(2)12-21(35)28-25(14-31)40-26-15-32(3,4)13-22(36)29(26)27(28)18-10-23(37-5)30(24(11-18)38-6)39-16-17-7-8-19(33)20(34)9-17/h7-11,27H,12-16H2,1-6H3
InChIKey
UDTBCNIATYQXOF-UHFFFAOYSA-N
Synonyms

9(4((34dichlorobenzyl)oxy)35dimethoxyphenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(4((34dichlorophenyl)methoxy)35dimethoxyphenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC(=C(C(=C4)OC)OCC5=CC(=C(C=C5)Cl)Cl)OC)C(=O)C1)C
InChI=1SC32H34Cl2O6c131(2)1221(35)2825(1431)40261532(34)1322(36)29(26)27(28)181023(375)30(24(1118)386)3916177819(33)20(34)917h71127H1216H216H3
MFCD01572669
ZINC000002190011
ZINC02190011
ZINC2190011

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Available files

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