Vitas-M small molecule compound

2,2'-{[4-(propan-2-yloxy)phenyl]methanediyl}bis[5-(4-methoxyphenyl)cyclohexane-1,3-dione]

Catalog ID
STK026768
SMILES COc1ccc(cc1)C1CC(=O)C(C(=O)C1)C(C1C(=O)CC(CC1=O)c1ccc(cc1)OC)c1ccc(cc1)OC(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 C36H38O7 MW 582.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H38O7/c1-21(2)43-29-15-9-24(10-16-29)34(35-30(37)17-25(18-31(35)38)22-5-11-27(41-3)12-6-22)36-32(39)19-26(20-33(36)40)23-7-13-28(42-4)14-8-23/h5-16,21,25-26,34-36H,17-20H2,1-4H3
InChIKey
CPQBVJIRKSSSTK-UHFFFAOYSA-N
Synonyms
329362-00-7
22((4(1METHYLETHOXY)PHENYL)METHANEDIYL)BIS(5(4METHOXYPHENYL)CYCLOHEXANE13DIONE)
22((4(PROPAN2YLOXY)PHENYL)METHANEDIYL)BIS(5(4METHOXYPHENYL)CYCLOHEXANE13DIONE)
22((4isopropoxyphenyl)methylene)bis(5(4methoxyphenyl)cyclohexane13dione)
329362007
5(4METHOXYPHENYL)2((4(4METHOXYPHENYL)26DIOXOCYCLOHEXYL)(4PROPAN2YLOXYPHENYL)METHYL)CYCLOHEXANE13DIONE
CC(C)OC1=CC=C(C=C1)C(C2C(=O)CC(CC2=O)C3=CC=C(C=C3)OC)C4C(=O)CC(CC4=O)C5=CC=C(C=C5)OC
COc1ccc(cc1)C1CC(=O)C(C(=O)C1)C(C1C(=O)CC(CC1=O)c1ccc(cc1)OC)c1ccc(cc1)OC(C)C
InChI=1SC36H38O7c121(2)432915924(101629)34(3530(37)1725(1831(35)38)2251127(413)12622)3632(39)1926(2033(36)40)2371328(424)14823h5162125263436H1720H214H3
MFCD00305521
STK026768
ZINC000101671951
ZINC101671951

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Available files

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