Vitas-M small molecule compound
9-{3,5-dichloro-2-[(2,4-dichlorobenzyl)oxy]phenyl}-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK674493
SMILES Clc1cc(Cl)c(c(c1)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C)OCc1ccc(cc1Cl)Cl
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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 C30H28Cl4O4 MW 594.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28Cl4O4/c1-29(2)10-21(35)26-23(12-29)38-24-13-30(3,4)11-22(36)27(24)25(26)18-7-17(32)9-20(34)28(18)37-14-15-5-6-16(31)8-19(15)33/h5-9,25H,10-14H2,1-4H3InChIKey
BCEHIPGLQYRQLA-UHFFFAOYSA-NSynonyms
9(35dichloro2((24dichlorobenzyl)oxy)phenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(35dichloro2((24dichlorophenyl)methoxy)phenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC(=CC(=C4OCC5=C(C=C(C=C5)Cl)Cl)Cl)Cl)C(=O)C1)C
InChI=1SC30H28Cl4O4c129(2)1021(35)2623(1229)38241330(34)1122(36)27(24)25(26)18717(32)920(34)28(18)3714155616(31)819(15)33h5925H1014H214H3
MFCD01160959
ZINC000003666589
ZINC03666589
ZINC3666589
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