Vitas-M small molecule compound
2,2'-[(4-chlorophenyl)methanediyl]bis[5-(4-methoxyphenyl)cyclohexane-1,3-dione]
Catalog ID
STK056837
SMILES COc1ccc(cc1)C1CC(=O)C(C(=O)C1)C(C1C(=O)CC(CC1=O)c1ccc(cc1)OC)c1ccc(cc1)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 C33H31ClO6 MW 559.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31ClO6/c1-39-25-11-5-19(6-12-25)22-15-27(35)32(28(36)16-22)31(21-3-9-24(34)10-4-21)33-29(37)17-23(18-30(33)38)20-7-13-26(40-2)14-8-20/h3-14,22-23,31-33H,15-18H2,1-2H3InChIKey
GTMHQNKJNOTNTB-UHFFFAOYSA-NSynonyms
2((4CHLOROPHENYL)(4(4METHOXYPHENYL)26DIOXOCYCLOHEXYL)METHYL)5(4METHOXYPHENYL)CYCLOHEXANE13DIONE
22((4CHLOROPHENYL)METHANEDIYL)BIS(5(4METHOXYPHENYL)CYCLOHEXANE13DIONE)
22((4chlorophenyl)methylene)bis(5(4methoxyphenyl)cyclohexane13dione)
COC1=CC=C(C=C1)C2CC(=O)C(C(=O)C2)C(C3C(=O)CC(CC3=O)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)Cl
COc1ccc(cc1)C1CC(=O)C(C(=O)C1)C(C1C(=O)CC(CC1=O)c1ccc(cc1)OC)c1ccc(cc1)Cl
InChI=1SC33H31ClO6c1392511519(61225)221527(35)32(28(36)1622)31(213924(34)10421)3329(37)1723(1830(33)38)2071326(402)14820h31422233133H1518H212H3
MFCD00305517
STK056837
ZINC000100509584
ZINC100509584
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.